N6-(3-chlorophenyl)-N4-(2-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-chlorophenyl)-N4-(2-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3-chlorophenyl)-N4-(2-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-chlorophenyl)-N4-(2-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(3-chlorophenyl)-4-N-(2-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]-o-phenetyl-amine Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H16ClN5O3/c1-2-27-15-9-4-3-8-14(15)23-18-16(24(25)26)17(20-11-21-18)22-13-7-5-6-12(19)10-13/h3-11H,2H2,1H3,(H2,20,21,22,23)