(6E)-6-[6-methyl-2-(4-methylpiperazin-1-yl)-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[6-methyl-2-(4-methylpiperazin-1-yl)-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[6-methyl-2-(4-methylpiperazin-1-yl)-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[6-methyl-2-(4-methyl-1-piperazinyl)-5-nitro-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[6-methyl-2-(4-methylpiperazin-1-yl)-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[6-methyl-2-(4-methylpiperazino)-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=CC2=O)N=C(N1)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(/C(=C\2/C=CC=CC2=O)/N=C(N1)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3/c1-11-15(21(23)24)14(12-5-3-4-6-13(12)22)18-16(17-11)20-9-7-19(2)8-10-20/h3-6H,7-10H2,1-2H3,(H,17,18)/b14-12+