N4-cyclohexyl-N6-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-cyclohexyl-N6-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cyclohexyl-N6-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cyclohexyl-N6-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cyclohexyl-6-N-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cyclohexyl-[5-nitro-6-(p-phenetidino)pyrimidin-4-yl]amine Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c1-2-26-15-10-8-14(9-11-15)22-18-16(23(24)25)17(19-12-20-18)21-13-6-4-3-5-7-13/h8-13H,2-7H2,1H3,(H2,19,20,21,22)