N6-(2-methoxyethyl)-5-nitro-N4-(4-phenoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(2-methoxyethyl)-5-nitro-N4-(4-phenoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N6-(2-methoxyethyl)-5-nitro-N4-(4-phenoxyphenyl)pyrimidine-4,6-diamine CAS Name: N6-(2-methoxyethyl)-5-nitro-N4-(4-phenoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(2-methoxyethyl)-5-nitro-4-N-(4-phenoxyphenyl)pyrimidine-4,6-diamine Traditional Name: 2-methoxyethyl-[5-nitro-6-(4-phenoxyanilino)pyrimidin-4-yl]amine Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

COCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H19N5O4/c1-27-12-11-20-18-17(24(25)26)19(22-13-21-18)23-14-7-9-16(10-8-14)28-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H2,20,21,22,23)