5-nitro-N4-propan-2-yl-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-propan-2-yl-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-5-nitro-N6-[2-(2-thienyl)ethyl]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-propan-2-yl-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-propan-2-yl-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Traditional Name: isopropyl-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]amine Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2

InChI

InChI=1S/C13H17N5O2S/c1-9(2)17-13-11(18(19)20)12(15-8-16-13)14-6-5-10-4-3-7-21-10/h3-4,7-9H,5-6H2,1-2H3,(H2,14,15,16,17)