4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-imidazol-1-yl-5-nitro-pyrimidine

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-imidazol-1-yl-5-nitro-pyrimidine Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-imidazol-1-yl-5-nitro-pyrimidine CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-6-(1-imidazolyl)-5-nitropyrimidine IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-imidazol-1-yl-5-nitropyrimidine Traditional Name: 4-[4-(2,3-dimethylphenyl)piperazino]-6-imidazol-1-yl-5-nitro-pyrimidine Formula: C19H21N7O2 MolecularWeight: 379.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4)C

InChI

InChI=1S/C19H21N7O2/c1-14-4-3-5-16(15(14)2)23-8-10-24(11-9-23)18-17(26(27)28)19(22-12-21-18)25-7-6-20-13-25/h3-7,12-13H,8-11H2,1-2H3