[2-(4-chlorophenyl)-3-(2-methylphenyl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]-cyclobutyl-methanone

Systemtic Name: [2-(4-chlorophenyl)-3-(2-methylphenyl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]-cyclobutyl-methanone Openeye Name: [2-(4-chlorophenyl)-3-(2-methylbenzoyl)-4-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]-cyclobutyl-methanone CAS Name: [2-(4-chlorophenyl)-3-[(2-methylphenyl)-oxomethyl]-4-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]-cyclobutylmethanone IUPAC Name: [2-(4-chlorophenyl)-3-(2-methylbenzoyl)-4-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]-cyclobutylmethanone Traditional Name: [2-(4-chlorophenyl)-4-(3-methyl-2-thienyl)-3-o-toluoyl-5-(piperazine-1-carbonyl)pyrrolidino]-cyclobutyl-methanone Formula: C33H36ClN3O3S MolecularWeight: 590.17524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4CCC4)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CC=C6C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4CCC4)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CC=C6C

InChI

InChI=1S/C33H36ClN3O3S/c1-20-6-3-4-9-25(20)30(38)26-27(31-21(2)14-19-41-31)29(33(40)36-17-15-35-16-18-36)37(32(39)23-7-5-8-23)28(26)22-10-12-24(34)13-11-22/h3-4,6,9-14,19,23,26-29,35H,5,7-8,15-18H2,1-2H3