2-azanyl-1-ethyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-1-ethyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile CAS Name: 2-amino-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-1-ethyl-6-keto-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Formula: C17H19N5O MolecularWeight: 309.36566

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(N=C1N)N2CCC3=CC=CC=C3CC2)C#N

Isomeric SMILES

CCN1C(=O)C(=C(N=C1N)N2CCC3=CC=CC=C3CC2)C#N

InChI

InChI=1S/C17H19N5O/c1-2-22-16(23)14(11-18)15(20-17(22)19)21-9-7-12-5-3-4-6-13(12)8-10-21/h3-6H,2,7-10H2,1H3,(H2,19,20)