N4-cyclohexyl-N6-(3-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-cyclohexyl-N6-(3-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cyclohexyl-N6-(3-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cyclohexyl-N6-(3-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cyclohexyl-6-N-(3-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cyclohexyl-[6-(m-anisidino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O3/c1-25-14-9-5-8-13(10-14)21-17-15(22(23)24)16(18-11-19-17)20-12-6-3-2-4-7-12/h5,8-12H,2-4,6-7H2,1H3,(H2,18,19,20,21)