6-[4-(1,4-diazepin-1-yl)-4-methyl-cyclohexyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-[4-(1,4-diazepin-1-yl)-4-methyl-cyclohexyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-[4-(1,4-diazepin-1-yl)-4-methyl-cyclohexyl]-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 6-[4-(1,4-diazepin-1-yl)-4-methylcyclohexyl]-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 6-[4-(1,4-diazepin-1-yl)-4-methylcyclohexyl]-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 6-[4-(1,4-diazepin-1-yl)-4-methyl-cyclohexyl]-2-keto-1H-pyridine-3-carbonitrile Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)C2=CC=C(C(=O)N2)C#N)N3C=CC=NC=C3

Isomeric SMILES

CC1(CCC(CC1)C2=CC=C(C(=O)N2)C#N)N3C=CC=NC=C3

InChI

InChI=1S/C18H20N4O/c1-18(22-11-2-9-20-10-12-22)7-5-14(6-8-18)16-4-3-15(13-19)17(23)21-16/h2-4,9-12,14H,5-8H2,1H3,(H,21,23)