N4,N6-bis(2-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-bis(2-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4,N6-bis(o-tolyl)pyrimidine-4,6-diamine CAS Name: N4,N6-bis(2-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-bis(2-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(o-toluidino)pyrimidin-4-yl]-(o-tolyl)amine Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O2/c1-12-7-3-5-9-14(12)21-17-16(23(24)25)18(20-11-19-17)22-15-10-6-4-8-13(15)2/h3-11H,1-2H3,(H2,19,20,21,22)