N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine

Systemtic Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine Openeye Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(4-phenylazophenyl)pyrimidine-4,6-diamine CAS Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[(2-chlorophenyl)methyl]-5-nitro-4-N-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[5-nitro-6-(4-phenylazoanilino)pyrimidin-4-yl]amine Formula: C23H18ClN7O2 MolecularWeight: 459.88772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC3=C(C(=NC=N3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC3=C(C(=NC=N3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN7O2/c24-20-9-5-4-6-16(20)14-25-22-21(31(32)33)23(27-15-26-22)28-17-10-12-19(13-11-17)30-29-18-7-2-1-3-8-18/h1-13,15H,14H2,(H2,25,26,27,28)