ethyl 2-methyl-1-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[2-[3-(methylthio)anilino]-2-oxoethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[2-(3-methylsulfanylanilino)-2-oxoethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-[3-(methylthio)anilino]ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)SC)C

InChI

InChI=1S/C23H24N2O3S/c1-4-28-23(27)20-14-21(17-9-6-5-7-10-17)25(16(20)2)15-22(26)24-18-11-8-12-19(13-18)29-3/h5-14H,4,15H2,1-3H3,(H,24,26)