4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-(3-cyanophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-(3-cyanophenyl)piperazine-1-carboxamide Openeye Name: 4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]-N-(3-cyanophenyl)piperazine-1-carboxamide CAS Name: 4-[[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-N-(3-cyanophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]-N-(3-cyanophenyl)piperazine-1-carboxamide Traditional Name: 4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]-N-(3-cyanophenyl)piperazine-1-carboxamide Formula: C31H28ClN5O3 MolecularWeight: 554.03872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2Cl)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C#N

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2Cl)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C#N

InChI

InChI=1S/C31H28ClN5O3/c1-21-26(19-29(23-10-12-25(40-2)13-11-23)37(21)28-9-4-3-8-27(28)32)30(38)35-14-16-36(17-15-35)31(39)34-24-7-5-6-22(18-24)20-33/h3-13,18-19H,14-17H2,1-2H3,(H,34,39)