N4-cyclopropyl-N2-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-(2-thienyl)ethyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-thiophen-2-ylethyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-2-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-5-nitropyrimidine-2,4-diamine Traditional Name: [2-[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]-1-(2-thienyl)ethyl]-dimethyl-amine Formula: C15H20N6O2S MolecularWeight: 348.4233

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=NC=C(C(=N1)NC2CC2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC1=NC=C(C(=N1)NC2CC2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C15H20N6O2S/c1-20(2)11(13-4-3-7-24-13)8-16-15-17-9-12(21(22)23)14(19-15)18-10-5-6-10/h3-4,7,9-11H,5-6,8H2,1-2H3,(H2,16,17,18,19)