2-(4-chlorophenyl)-3-(4-cyanophenyl)carbonyl-4-(3,4-dimethoxyphenyl)-N-ethyl-5-piperazin-1-ylcarbonyl-pyrrolidine-1-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-3-(4-cyanophenyl)carbonyl-4-(3,4-dimethoxyphenyl)-N-ethyl-5-piperazin-1-ylcarbonyl-pyrrolidine-1-carboxamide Openeye Name: 2-(4-chlorophenyl)-3-(4-cyanobenzoyl)-4-(3,4-dimethoxyphenyl)-N-ethyl-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide CAS Name: 2-(4-chlorophenyl)-3-[(4-cyanophenyl)-oxomethyl]-4-(3,4-dimethoxyphenyl)-N-ethyl-5-[oxo(1-piperazinyl)methyl]-1-pyrrolidinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-3-(4-cyanobenzoyl)-4-(3,4-dimethoxyphenyl)-N-ethyl-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide Traditional Name: 2-(4-chlorophenyl)-3-(4-cyanobenzoyl)-4-(3,4-dimethoxyphenyl)-N-ethyl-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide Formula: C34H36ClN5O5 MolecularWeight: 630.13314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=CC=C(C=C4)C#N)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=CC=C(C=C4)C#N)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C34H36ClN5O5/c1-4-38-34(43)40-30(22-9-12-25(35)13-10-22)29(32(41)23-7-5-21(20-36)6-8-23)28(24-11-14-26(44-2)27(19-24)45-3)31(40)33(42)39-17-15-37-16-18-39/h5-14,19,28-31,37H,4,15-18H2,1-3H3,(H,38,43)