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

Systemtic Name: methyl 5-methylsulfanyl-4-[4-[4-(methylsulfonylamino)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate Openeye Name: methyl 4-[4-[4-(methanesulfonamido)phenyl]thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-[4-[4-(methanesulfonamido)phenyl]-2-thiazolyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-(methanesulfonamido)phenyl]-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-[4-[4-(methanesulfonamido)phenyl]thiazol-2-yl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C17H16N2O4S4 MolecularWeight: 440.57994

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4S4/c1-23-16(20)14-8-12(17(24-2)26-14)15-18-13(9-25-15)10-4-6-11(7-5-10)19-27(3,21)22/h4-9,19H,1-3H3