2-[5-cyano-4-oxidanylidene-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]ethanamide

Systemtic Name: 2-[5-cyano-4-oxidanylidene-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]ethanamide Openeye Name: 2-[5-cyano-4-oxo-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]acetamide CAS Name: 2-[5-cyano-4-oxo-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]acetamide IUPAC Name: 2-[5-cyano-4-oxo-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]acetamide Traditional Name: 2-[5-cyano-4-keto-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-2-yl]acetamide Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=CC=CC=C21)C3=C(C(=O)N=C(N3)CC(=O)N)C#N

Isomeric SMILES

C1CN(CCC2=CC=CC=C21)C3=C(C(=O)N=C(N3)CC(=O)N)C#N

InChI

InChI=1S/C17H17N5O2/c18-10-13-16(20-15(9-14(19)23)21-17(13)24)22-7-5-11-3-1-2-4-12(11)6-8-22/h1-4H,5-9H2,(H2,19,23)(H,20,21,24)