941925-68-4
5-THIAZOLECARBOXAMIDE, N-1,3-BENZODIOXOL-5-YL-2-[[(4-METHOXYPHENYL)SULFONYL]AMINO]-4-METHYL-
Name5-THIAZOLECARBOXAMIDE, N-1,3-BENZODIOXOL-5-YL-2-[[(4-METHOXYPHENYL)SULFONYL]AMINO]-4-METHYL-
pro_formulaC19 H17 N3 O6 S2
1Identification
【Name】
5-THIAZOLECARBOXAMIDE, N-1,3-BENZODIOXOL-5-YL-2-[[(4-METHOXYPHENYL)SULFONYL]AMINO]-4-METHYL-
【CAS】
【MDL】
MFCD09245637
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C19 H17 N3 O6 S2
【pro_molWeight】
447.49
【Inchi】
InChI=1S/C19H17N3O6S2/c1-11-17(18(23)21-12-3-8-15-16(9-12)28-10-27-15)29-19(20-11)22-30(24,25)14-6-4-13(26-2)5-7-14/h3-9H,10H2,1-2H3,(H,20,22)(H,21,23)
【InChIKey】
InChIKey=VYTLKMXUPIECPO-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccc(cc2)OC)C(=O)Nc3ccc4c(c3)OCO4
【MOL File】
5-THIAZOLECARBOXAMID….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:9
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-THIAZOLECARBOXAMIDE, N-1,3-BENZODIOXOL-5-YL-2-[[(4-METHOXYPHENYL)SULFONYL]AMINO]-4-METHYL-.cml