4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonyl-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonyl-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: 4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: 4-[[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-N-[4-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: 4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]-N-[4-(methylthio)phenyl]piperazine-1-carboxamide Formula: C32H34N4O4S MolecularWeight: 570.70176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)SC

Isomeric SMILES

CC1=C(C=C(N1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)SC

InChI

InChI=1S/C32H34N4O4S/c1-22-27(31(37)34-16-18-35(19-17-34)32(38)33-24-10-13-26(41-4)14-11-24)21-28(23-8-6-5-7-9-23)36(22)25-12-15-29(39-2)30(20-25)40-3/h5-15,20-21H,16-19H2,1-4H3,(H,33,38)