methyl 4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]thieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: methyl 4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]thieno[3,2-b]pyrrole-5-carboxylate Openeye Name: methyl 4-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]thieno[3,2-b]pyrrole-5-carboxylate CAS Name: 4-[2-[3-(methylthio)anilino]-2-oxoethyl]-5-thieno[3,2-b]pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(3-methylsulfanylanilino)-2-oxoethyl]thieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-[2-keto-2-[3-(methylthio)anilino]ethyl]thieno[3,2-b]pyrrole-5-carboxylic acid methyl ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1CC(=O)NC3=CC(=CC=C3)SC)C=CS2

Isomeric SMILES

COC(=O)C1=CC2=C(N1CC(=O)NC3=CC(=CC=C3)SC)C=CS2

InChI

InChI=1S/C17H16N2O3S2/c1-22-17(21)14-9-15-13(6-7-24-15)19(14)10-16(20)18-11-4-3-5-12(8-11)23-2/h3-9H,10H2,1-2H3,(H,18,20)