N6-(4-chlorophenyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4-chlorophenyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-chlorophenyl)-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-chlorophenyl)-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-chlorophenyl)-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C17H14ClN5O2 MolecularWeight: 355.77836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2/c1-11-3-2-4-14(9-11)22-17-15(23(24)25)16(19-10-20-17)21-13-7-5-12(18)6-8-13/h2-10H,1H3,(H2,19,20,21,22)