My_ChemCD

585549-56-0
N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE

Directory: 1. Identification; 2. ChemicalProperties; 3. MaterialMSDS; 4. CMLFile; 5. SuppliersList; 6. Relatedproducts

Name

N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE

pro_formula

C20 H19 F2 N3 O2 S2

pro_molWeight

435.517

pro_cdbregno

CCD00439380

CAS

585549-56-0

MDL

MFCD04027961

1Identification

【Name】

N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE

【CAS】

585549-56-0

【MDL】

MFCD04027961

【中文同义词】

【EnglishSynonyms】

N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE

【pro_formula】

C20 H19 F2 N3 O2 S2

【pro_molWeight】

435.517

【Inchi】

InChI=1S/C20H19F2N3O2S2/c1-2-25-19(27)17-12-5-3-4-6-15(12)29-18(17)24-20(25)28-10-16(26)23-14-8-7-11(21)9-13(14)22/h7-9H,2-6,10H2,1H3,(H,23,26)

【InChIKey】

InChIKey=OJUKGEQWZNLRPI-UHFFFAOYSA-N

【SMILES】

CCn1c(=O)c2c3c(sc2nc1SCC(=O)Nc4ccc(cc4F)F)CCCC3

【MOL File】

N-(2,4-DIFLUOROPHENY….mol

2ChemicalProperties

【ComputedProperties】

pro_donors:1

pro_acceptors:5

XLogP3:4.0

Bulk/Fine:F

3MaterialMSDS

4CMLFile

N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE.cml

quick_release

SuppliersList

Sigma-Aldrich Corporation
pro_catalogNo:L413151-1EA 10MG
CountryRegion:US
BusinessType:ReagentCompany
http://www.sigma-aldrich.com

More 585549-56-0 select_supply>>

585549-56-0 N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE

1Identification

【Name】

【CAS】

【MDL】

【中文同义词】

【EnglishSynonyms】

【pro_formula】

【pro_molWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2ChemicalProperties

【ComputedProperties】

3MaterialMSDS

4CMLFile

SuppliersList

Relatedproducts

585549-56-0
N-(2,4-DIFLUOROPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE