941925-55-9
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-N-(2-THIENYLMETHYL)-5-THIAZOLECARBOXAMIDE
Name4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-N-(2-THIENYLMETHYL)-5-THIAZOLECARBOXAMIDE
pro_formulaC17 H17 N3 O3 S3
1Identification
【Name】
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-N-(2-THIENYLMETHYL)-5-THIAZOLECARBOXAMIDE
【CAS】
【MDL】
MFCD09245617
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H17 N3 O3 S3
【pro_molWeight】
407.537
【Inchi】
InChI=1S/C17H17N3O3S3/c1-11-5-7-14(8-6-11)26(22,23)20-17-19-12(2)15(25-17)16(21)18-10-13-4-3-9-24-13/h3-9H,10H2,1-2H3,(H,18,21)(H,19,20)
【InChIKey】
InChIKey=PMMPWNJCIFVTGD-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)Nc2nc(c(s2)C(=O)NCc3cccs3)C
【MOL File】
4-METHYL-2-[[(4-METH….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-N-(2-THIENYLMETHYL)-5-THIAZOLECARBOXAMIDE.cml