N2-(4-chlorophenyl)-N4-(4-ethoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4-(4-ethoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4-(4-ethoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4-(4-ethoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-(4-ethoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(4-chloroanilino)-6-methyl-5-nitro-pyrimidin-4-yl]-p-phenetyl-amine Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN5O3/c1-3-28-16-10-8-14(9-11-16)22-18-17(25(26)27)12(2)21-19(24-18)23-15-6-4-13(20)5-7-15/h4-11H,3H2,1-2H3,(H2,21,22,23,24)