[4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[2-morpholinoethyl(p-tolylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(4-methylphenyl)methyl-[2-(4-morpholinyl)ethyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[(4-methylbenzyl)-(2-morpholinoethyl)amino]-1-nicotinoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C29H40N6O3 MolecularWeight: 520.6663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)N5CCNCC5

InChI

InChI=1S/C29H40N6O3/c1-23-4-6-24(7-5-23)21-34(14-13-32-15-17-38-18-16-32)26-19-27(29(37)33-11-9-30-10-12-33)35(22-26)28(36)25-3-2-8-31-20-25/h2-8,20,26-27,30H,9-19,21-22H2,1H3