N-[5-cyano-1-ethyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]methanamide

Systemtic Name: N-[5-cyano-1-ethyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]methanamide Openeye Name: N-[5-cyano-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]formamide CAS Name: N-[5-cyano-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-pyrimidinyl]formamide IUPAC Name: N-[5-cyano-1-ethyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]formamide Traditional Name: N-[5-cyano-1-ethyl-6-keto-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]formamide Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(N=C1NC=O)N2CCC3=CC=CC=C3CC2)C#N

Isomeric SMILES

CCN1C(=O)C(=C(N=C1NC=O)N2CCC3=CC=CC=C3CC2)C#N

InChI

InChI=1S/C18H19N5O2/c1-2-23-17(25)15(11-19)16(21-18(23)20-12-24)22-9-7-13-5-3-4-6-14(13)8-10-22/h3-6,12H,2,7-10H2,1H3,(H,20,21,24)