methyl 5-methylsulfanyl-4-[4-[4-(phenylsulfonylamino)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate

Systemtic Name: methyl 5-methylsulfanyl-4-[4-[4-(phenylsulfonylamino)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate Openeye Name: methyl 4-[4-[4-(benzenesulfonamido)phenyl]thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-[4-[4-(benzenesulfonamido)phenyl]-2-thiazolyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-(benzenesulfonamido)phenyl]-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-[4-[4-(benzenesulfonamido)phenyl]thiazol-2-yl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C22H18N2O4S4 MolecularWeight: 502.64932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S4/c1-28-21(25)19-12-17(22(29-2)31-19)20-23-18(13-30-20)14-8-10-15(11-9-14)24-32(26,27)16-6-4-3-5-7-16/h3-13,24H,1-2H3