1-[1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-N-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: 1-[1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-N-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: 1-[5-oxo-1-(p-tolyl)pyrrolidine-3-carbonyl]-N-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: 1-[[1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-N-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]-N-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: 1-[5-keto-1-(p-tolyl)pyrrolidine-3-carbonyl]-N-(2-pyrimidyl)isonipecotamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=NC=CC=N4

InChI

InChI=1S/C22H25N5O3/c1-15-3-5-18(6-4-15)27-14-17(13-19(27)28)21(30)26-11-7-16(8-12-26)20(29)25-22-23-9-2-10-24-22/h2-6,9-10,16-17H,7-8,11-14H2,1H3,(H,23,24,25,29)