4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidine

Systemtic Name: 4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidine Openeye Name: 2-(4-benzylpiperazin-1-yl)-4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-pyrimidine CAS Name: 4-methyl-6-(2-methyl-1-imidazolyl)-5-nitro-2-[4-(phenylmethyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-(4-benzylpiperazin-1-yl)-4-methyl-6-(2-methylimidazol-1-yl)-5-nitropyrimidine Traditional Name: 2-(4-benzylpiperazino)-4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-pyrimidine Formula: C20H23N7O2 MolecularWeight: 393.44232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)N4C=CN=C4C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)N4C=CN=C4C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O2/c1-15-18(27(28)29)19(26-9-8-21-16(26)2)23-20(22-15)25-12-10-24(11-13-25)14-17-6-4-3-5-7-17/h3-9H,10-14H2,1-2H3