N-[(2,3-dimethoxyphenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]-o-veratryl-amine Formula: C18H24N6O4 MolecularWeight: 388.42096

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)NCC3=C(C(=CC=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)NCC3=C(C(=CC=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H24N6O4/c1-22-7-9-23(10-8-22)18-15(24(25)26)17(20-12-21-18)19-11-13-5-4-6-14(27-2)16(13)28-3/h4-6,12H,7-11H2,1-3H3,(H,19,20,21)