[3-(3-chlorophenyl)carbonyl-2-(2-phenylethenyl)-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]-cyclohexyl-methanone

Systemtic Name: [3-(3-chlorophenyl)carbonyl-2-(2-phenylethenyl)-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]-cyclohexyl-methanone Openeye Name: [4-(3-chlorobenzoyl)-2-(piperazine-1-carbonyl)-5-styryl-3-(2-thienyl)pyrrolidin-1-yl]-cyclohexyl-methanone CAS Name: [4-[(3-chlorophenyl)-oxomethyl]-2-[oxo(1-piperazinyl)methyl]-5-(2-phenylethenyl)-3-thiophen-2-yl-1-pyrrolidinyl]-cyclohexylmethanone IUPAC Name: [3-(3-chlorobenzoyl)-2-(2-phenylethenyl)-5-(piperazine-1-carbonyl)-4-thiophen-2-ylpyrrolidin-1-yl]-cyclohexylmethanone Traditional Name: [4-(3-chlorobenzoyl)-2-(piperazine-1-carbonyl)-5-styryl-3-(2-thienyl)pyrrolidino]-cyclohexyl-methanone Formula: C35H38ClN3O3S MolecularWeight: 616.21252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl)C=CC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl)C=CC6=CC=CC=C6

InChI

InChI=1S/C35H38ClN3O3S/c36-27-14-7-13-26(23-27)33(40)30-28(17-16-24-9-3-1-4-10-24)39(34(41)25-11-5-2-6-12-25)32(31(30)29-15-8-22-43-29)35(42)38-20-18-37-19-21-38/h1,3-4,7-10,13-17,22-23,25,28,30-32,37H,2,5-6,11-12,18-21H2