[2,4-dimethyl-6-(3-nitrophenyl)pyrimidin-5-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [2,4-dimethyl-6-(3-nitrophenyl)pyrimidin-5-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [2,4-dimethyl-6-(3-nitrophenyl)pyrimidin-5-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [2,4-dimethyl-6-(3-nitrophenyl)-5-pyrimidinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [2,4-dimethyl-6-(3-nitrophenyl)pyrimidin-5-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [2,4-dimethyl-6-(3-nitrophenyl)pyrimidin-5-yl]-(4-methylpiperazino)methanone Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)N2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)N2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N5O3/c1-12-16(18(24)22-9-7-21(3)8-10-22)17(20-13(2)19-12)14-5-4-6-15(11-14)23(25)26/h4-6,11H,7-10H2,1-3H3