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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2

Isomeric SMILES

CCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2

InChI

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