(2R)-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-pyridin-3-ylcarbonyl-1-pyrimidin-5-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: (2R)-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-pyridin-3-ylcarbonyl-1-pyrimidin-5-ylcarbonyl-piperazine-2-carboxamide Openeye Name: (2R)-N-[(3S)-2-oxo-3-piperidyl]-4-(pyridine-3-carbonyl)-1-(pyrimidine-5-carbonyl)piperazine-2-carboxamide CAS Name: (2R)-N-[(3S)-2-oxo-3-piperidinyl]-4-[oxo(3-pyridinyl)methyl]-1-[oxo(5-pyrimidinyl)methyl]-2-piperazinecarboxamide IUPAC Name: (2R)-N-[(3S)-2-oxopiperidin-3-yl]-4-(pyridine-3-carbonyl)-1-(pyrimidine-5-carbonyl)piperazine-2-carboxamide Traditional Name: (2R)-N-[(3S)-2-keto-3-piperidyl]-4-nicotinoyl-1-(pyrimidine-5-carbonyl)piperazine-2-carboxamide Formula: C21H23N7O4 MolecularWeight: 437.45182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)NC(=O)C2CN(CCN2C(=O)C3=CN=CN=C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1C[C@@H](C(=O)NC1)NC(=O)[C@H]2CN(CCN2C(=O)C3=CN=CN=C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H23N7O4/c29-18-16(4-2-6-25-18)26-19(30)17-12-27(20(31)14-3-1-5-22-9-14)7-8-28(17)21(32)15-10-23-13-24-11-15/h1,3,5,9-11,13,16-17H,2,4,6-8,12H2,(H,25,29)(H,26,30)/t16-,17+/m0/s1