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

Systemtic Name: [5-cyano-2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]methylcarbamic acid Openeye Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]methylcarbamic acid CAS Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-pyrimidinyl]methylcarbamic acid IUPAC Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]methylcarbamic acid Traditional Name: [5-cyano-6-keto-2-methyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]methylcarbamic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1CNC(=O)O)C#N)N2CCC3=CC=CC=C3CC2

Isomeric SMILES

CC1=NC(=C(C(=O)N1CNC(=O)O)C#N)N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C18H19N5O3/c1-12-21-16(15(10-19)17(24)23(12)11-20-18(25)26)22-8-6-13-4-2-3-5-14(13)7-9-22/h2-5,20H,6-9,11H2,1H3,(H,25,26)