ethyl 1-methyl-5-oxidanylidene-4-[(4-phenylsulfanylphenyl)amino]-2H-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-methyl-5-oxidanylidene-4-[(4-phenylsulfanylphenyl)amino]-2H-pyrrole-3-carboxylate Openeye Name: ethyl 1-methyl-5-oxo-4-(4-phenylsulfanylanilino)-2H-pyrrole-3-carboxylate CAS Name: 1-methyl-5-oxo-4-[4-(phenylthio)anilino]-2H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-oxo-4-(4-phenylsulfanylanilino)-2H-pyrrole-3-carboxylate Traditional Name: 5-keto-1-methyl-4-[4-(phenylthio)anilino]-3-pyrroline-3-carboxylic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C1)C)NC2=CC=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C1)C)NC2=CC=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-3-25-20(24)17-13-22(2)19(23)18(17)21-14-9-11-16(12-10-14)26-15-7-5-4-6-8-15/h4-12,21H,3,13H2,1-2H3