N4-butan-2-yl-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butan-2-yl-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3-methoxypropyl)-5-nitro-N4-sec-butyl-pyrimidine-4,6-diamine CAS Name: N4-butan-2-yl-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butan-2-yl-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 3-methoxypropyl-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]amine Formula: C12H21N5O3 MolecularWeight: 283.32684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCCOC

Isomeric SMILES

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCCOC

InChI

InChI=1S/C12H21N5O3/c1-4-9(2)16-12-10(17(18)19)11(14-8-15-12)13-6-5-7-20-3/h8-9H,4-7H2,1-3H3,(H2,13,14,15,16)