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

Systemtic Name: [5-cyano-2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]-ethyl-carbamic acid Openeye Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]-ethyl-carbamic acid CAS Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-pyrimidinyl]-ethylcarbamic acid IUPAC Name: [5-cyano-2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]-ethylcarbamic acid Traditional Name: [5-cyano-6-keto-2-methyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-1-yl]-ethyl-carbamic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)O)N1C(=NC(=C(C1=O)C#N)N2CCC3=CC=CC=C3CC2)C

Isomeric SMILES

CCN(C(=O)O)N1C(=NC(=C(C1=O)C#N)N2CCC3=CC=CC=C3CC2)C

InChI

InChI=1S/C19H21N5O3/c1-3-23(19(26)27)24-13(2)21-17(16(12-20)18(24)25)22-10-8-14-6-4-5-7-15(14)9-11-22/h4-7H,3,8-11H2,1-2H3,(H,26,27)