6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(1-naphthyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N-(1-naphthalenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-naphthalen-1-yl-5-nitropyrimidin-4-amine Traditional Name: [6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(1-naphthyl)amine Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=CC5=CC=CC=C54)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=CC5=CC=CC=C54)[N+](=O)[O-])C

InChI

InChI=1S/C26H26N6O2/c1-18-7-5-12-23(19(18)2)30-13-15-31(16-14-30)26-24(32(33)34)25(27-17-28-26)29-22-11-6-9-20-8-3-4-10-21(20)22/h3-12,17H,13-16H2,1-2H3,(H,27,28,29)