3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-one

Systemtic Name: 3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-one Openeye Name: 3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-one CAS Name: 3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-4-pyrimidinone IUPAC Name: 3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-one Traditional Name: 3-butyl-2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-one Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC(=C(C1=O)[N+](=O)[O-])N2CCC3=CC=CC=C3CC2)C

Isomeric SMILES

CCCCN1C(=NC(=C(C1=O)[N+](=O)[O-])N2CCC3=CC=CC=C3CC2)C

InChI

InChI=1S/C19H24N4O3/c1-3-4-11-22-14(2)20-18(17(19(22)24)23(25)26)21-12-9-15-7-5-6-8-16(15)10-13-21/h5-8H,3-4,9-13H2,1-2H3