[4-[2-methylpropyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[2-methylpropyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[benzyl(isobutyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[2-methylpropyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[benzyl(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[benzyl(isobutyl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C26H35N5O2 MolecularWeight: 449.5884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)N4CCNCC4

Isomeric SMILES

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)N4CCNCC4

InChI

InChI=1S/C26H35N5O2/c1-20(2)17-30(18-21-7-4-3-5-8-21)23-15-24(26(33)29-13-11-27-12-14-29)31(19-23)25(32)22-9-6-10-28-16-22/h3-10,16,20,23-24,27H,11-15,17-19H2,1-2H3