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

Systemtic Name: N4-[(2-chlorophenyl)methyl]-N6-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[(2-chlorophenyl)methyl]-5-nitro-N6-(p-tolylmethyl)pyrimidine-4,6-diamine CAS Name: N4-[(2-chlorophenyl)methyl]-N6-[(4-methylphenyl)methyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[(2-chlorophenyl)methyl]-6-N-[(4-methylphenyl)methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[6-[(4-methylbenzyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C19H18ClN5O2 MolecularWeight: 383.83152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O2/c1-13-6-8-14(9-7-13)10-21-18-17(25(26)27)19(24-12-23-18)22-11-15-4-2-3-5-16(15)20/h2-9,12H,10-11H2,1H3,(H2,21,22,23,24)