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

Systemtic Name: N6-ethyl-5-nitro-N4-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Openeye Name: N6-ethyl-5-nitro-N4-[2-(2-thienyl)ethyl]pyrimidine-4,6-diamine CAS Name: N6-ethyl-5-nitro-N4-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-ethyl-5-nitro-4-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Traditional Name: ethyl-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]amine Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=NC=N1)NCCC2=CC=CS2)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C(=NC=N1)NCCC2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N5O2S/c1-2-13-11-10(17(18)19)12(16-8-15-11)14-6-5-9-4-3-7-20-9/h3-4,7-8H,2,5-6H2,1H3,(H2,13,14,15,16)