N4-cyclopentyl-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-cyclopentyl-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cyclopentyl-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cyclopentyl-N6-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cyclopentyl-6-N-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cyclopentyl-[5-nitro-6-(o-anisidino)pyrimidin-4-yl]amine Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(C(=NC=N2)NC3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC2=C(C(=NC=N2)NC3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3/c1-24-13-9-5-4-8-12(13)20-16-14(21(22)23)15(17-10-18-16)19-11-6-2-3-7-11/h4-5,8-11H,2-3,6-7H2,1H3,(H2,17,18,19,20)