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

Systemtic Name: N4-(diphenylmethyl)-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N4-benzhydryl-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine CAS Name: N4-(diphenylmethyl)-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzhydryl-5-nitro-6-N-(4-phenoxyphenyl)pyrimidine-4,6-diamine Traditional Name: benzhydryl-[5-nitro-6-(4-phenoxyanilino)pyrimidin-4-yl]amine Formula: C29H23N5O3 MolecularWeight: 489.52462

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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=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H23N5O3/c35-34(36)27-28(32-23-16-18-25(19-17-23)37-24-14-8-3-9-15-24)30-20-31-29(27)33-26(21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-20,26H,(H2,30,31,32,33)