N-(2-methylpropyl)-6-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)-1H-pyrimidine-5-carboxamide

Systemtic Name: N-(2-methylpropyl)-6-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)-1H-pyrimidine-5-carboxamide Openeye Name: N-isobutyl-6-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)-1H-pyrimidine-5-carboxamide CAS Name: N-(2-methylpropyl)-6-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrimidine-5-carboxamide IUPAC Name: N-(2-methylpropyl)-6-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)-1H-pyrimidine-5-carboxamide Traditional Name: N-isobutyl-6-keto-2-[4-(2-pyrimidyl)piperazino]-1H-pyrimidine-5-carboxamide Formula: C17H23N7O2 MolecularWeight: 357.41022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)CNC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H23N7O2/c1-12(2)10-20-14(25)13-11-21-17(22-15(13)26)24-8-6-23(7-9-24)16-18-4-3-5-19-16/h3-5,11-12H,6-10H2,1-2H3,(H,20,25)(H,21,22,26)