[5-cyano-6-oxidanylidene-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]-methyl-cyanamide

Systemtic Name: [5-cyano-6-oxidanylidene-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]-methyl-cyanamide Openeye Name: [1-allyl-5-cyano-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]-methyl-cyanamide CAS Name: [5-cyano-6-oxo-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-pyrimidinyl]-methylcyanamide IUPAC Name: [5-cyano-6-oxo-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]-methylcyanamide Traditional Name: [1-allyl-5-cyano-6-keto-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-2-yl]-methyl-cyanamide Formula: C20H20N6O MolecularWeight: 360.4124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C#N)C1=NC(=C(C(=O)N1CC=C)C#N)N2CCC3=CC=CC=C3CC2

Isomeric SMILES

CN(C#N)C1=NC(=C(C(=O)N1CC=C)C#N)N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C20H20N6O/c1-3-10-26-19(27)17(13-21)18(23-20(26)24(2)14-22)25-11-8-15-6-4-5-7-16(15)9-12-25/h3-7H,1,8-12H2,2H3