6-methyl-4-oxidanylidene-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepine-3-carbonitrile

Systemtic Name: 6-methyl-4-oxidanylidene-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepine-3-carbonitrile Openeye Name: 6-methyl-4-oxo-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepine-3-carbonitrile CAS Name: 6-methyl-4-oxo-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepine-3-carbonitrile IUPAC Name: 6-methyl-4-oxo-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepine-3-carbonitrile Traditional Name: 4-keto-6-methyl-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepine-3-carbonitrile Formula: C11H13N3O MolecularWeight: 203.24042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC2=NC=C(C(=O)N12)C#N

Isomeric SMILES

CC1CCCCC2=NC=C(C(=O)N12)C#N

InChI

InChI=1S/C11H13N3O/c1-8-4-2-3-5-10-13-7-9(6-12)11(15)14(8)10/h7-8H,2-5H2,1H3