azanyl-[5-cyano-2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]carbamic acid

Systemtic Name: azanyl-[5-cyano-2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]carbamic acid Openeye Name: amino-[5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]carbamic acid CAS Name: amino-[5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-pyrimidinyl]carbamic acid IUPAC Name: amino-[5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]carbamic acid Traditional Name: amino-[5-cyano-6-keto-2-methyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]carbamic acid Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1N(C(=O)O)N)C#N)N2CCC3=CC=CC=C3CC2

Isomeric SMILES

CC1=NC(=C(C(=O)N1N(C(=O)O)N)C#N)N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C17H18N6O3/c1-11-20-15(14(10-18)16(24)22(11)23(19)17(25)26)21-8-6-12-4-2-3-5-13(12)7-9-21/h2-5H,6-9,19H2,1H3,(H,25,26)