2-(azepan-1-yl)-N-[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-(azepan-1-yl)-N-[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-oxo-acetamide CAS Name: 2-(1-azepanyl)-N-[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-oxoacetamide IUPAC Name: 2-(azepan-1-yl)-N-[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-oxoacetamide Traditional Name: 2-(azepan-1-yl)-2-keto-N-[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]acetamide Formula: C17H22N6O3 MolecularWeight: 358.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)C(=O)N3CCCCCC3

InChI

InChI=1S/C17H22N6O3/c1-11-10-14(24)20-17(18-11)23-13(9-12(2)21-23)19-15(25)16(26)22-7-5-3-4-6-8-22/h9-10H,3-8H2,1-2H3,(H,19,25)(H,18,20,24)