[4-[cyclopropyl-(phenylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[cyclopropyl-(phenylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[benzyl(cyclopropyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclopropyl-(phenylmethyl)amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[benzyl(cyclopropyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[benzyl(cyclopropyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazino-methanone Formula: C26H31FN4O2 MolecularWeight: 450.548343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)N5CCNCC5

Isomeric SMILES

C1CC1N(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)N5CCNCC5

InChI

InChI=1S/C26H31FN4O2/c27-21-8-6-20(7-9-21)25(32)31-18-23(16-24(31)26(33)29-14-12-28-13-15-29)30(22-10-11-22)17-19-4-2-1-3-5-19/h1-9,22-24,28H,10-18H2