N6-(3-bromophenyl)-N4-(diphenylmethyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-bromophenyl)-N4-(diphenylmethyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-benzhydryl-N6-(3-bromophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-bromophenyl)-N4-(diphenylmethyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-benzhydryl-6-N-(3-bromophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzhydryl-[6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C23H18BrN5O2 MolecularWeight: 476.32532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H18BrN5O2/c24-18-12-7-13-19(14-18)27-22-21(29(30)31)23(26-15-25-22)28-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-15,20H,(H2,25,26,27,28)