cyclopropyl-[4-(4-methoxyphenyl)carbonyl-3-phenyl-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidin-1-yl]methanone

Systemtic Name: cyclopropyl-[4-(4-methoxyphenyl)carbonyl-3-phenyl-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidin-1-yl]methanone Openeye Name: cyclopropyl-[4-(4-methoxybenzoyl)-3-phenyl-2-(piperazine-1-carbonyl)-5-(2-thienyl)pyrrolidin-1-yl]methanone CAS Name: cyclopropyl-[4-[(4-methoxyphenyl)-oxomethyl]-2-[oxo(1-piperazinyl)methyl]-3-phenyl-5-thiophen-2-yl-1-pyrrolidinyl]methanone IUPAC Name: cyclopropyl-[4-(4-methoxybenzoyl)-3-phenyl-2-(piperazine-1-carbonyl)-5-thiophen-2-ylpyrrolidin-1-yl]methanone Traditional Name: cyclopropyl-[4-p-anisoyl-3-phenyl-2-(piperazine-1-carbonyl)-5-(2-thienyl)pyrrolidino]methanone Formula: C31H33N3O4S MolecularWeight: 543.67642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=CS3)C(=O)C4CC4)C(=O)N5CCNCC5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=CS3)C(=O)C4CC4)C(=O)N5CCNCC5)C6=CC=CC=C6

InChI

InChI=1S/C31H33N3O4S/c1-38-23-13-11-21(12-14-23)29(35)26-25(20-6-3-2-4-7-20)28(31(37)33-17-15-32-16-18-33)34(30(36)22-9-10-22)27(26)24-8-5-19-39-24/h2-8,11-14,19,22,25-28,32H,9-10,15-18H2,1H3