955642-43-0
5-THIAZOLECARBOXAMIDE, N-[2-[4-(AMINOSULFONYL)PHENYL]ETHYL]-4-METHYL-2-[(PHENYLSULFONYL)AMINO]-
Name5-THIAZOLECARBOXAMIDE, N-[2-[4-(AMINOSULFONYL)PHENYL]ETHYL]-4-METHYL-2-[(PHENYLSULFONYL)AMINO]-
pro_formulaC19 H20 N4 O5 S3
1Identification
【Name】
5-THIAZOLECARBOXAMIDE, N-[2-[4-(AMINOSULFONYL)PHENYL]ETHYL]-4-METHYL-2-[(PHENYLSULFONYL)AMINO]-
【CAS】
【MDL】
MFCD15528253
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C19 H20 N4 O5 S3
【pro_molWeight】
480.588
【Inchi】
InChI=1S/C19H20N4O5S3/c1-13-17(29-19(22-13)23-31(27,28)16-5-3-2-4-6-16)18(24)21-12-11-14-7-9-15(10-8-14)30(20,25)26/h2-10H,11-12H2,1H3,(H,21,24)(H,22,23)(H2,20,25,26)
【InChIKey】
InChIKey=WVPSQUCDUNCLRF-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccccc2)C(=O)NCCc3ccc(cc3)S(=O)(=O)N
【MOL File】
5-THIAZOLECARBOXAMID….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:9
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-THIAZOLECARBOXAMIDE, N-[2-[4-(AMINOSULFONYL)PHENYL]ETHYL]-4-METHYL-2-[(PHENYLSULFONYL)AMINO]-.cml