3-oxidanylidene-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile

Systemtic Name: 3-oxidanylidene-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile Openeye Name: 3-oxo-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile CAS Name: 3-oxo-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile IUPAC Name: 3-oxo-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile Traditional Name: 3-keto-5-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2H-1,2,4-triazine-6-carbonitrile Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=CC=CC=C21)C3=NC(=O)NN=C3C#N

Isomeric SMILES

C1CN(CCC2=CC=CC=C21)C3=NC(=O)NN=C3C#N

InChI

InChI=1S/C14H13N5O/c15-9-12-13(16-14(20)18-17-12)19-7-5-10-3-1-2-4-11(10)6-8-19/h1-4H,5-8H2,(H,16,18,20)