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N4-(3-methylbutyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

N4-(3-methylbutyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

Systemtic Name:N4-(3-methylbutyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
Openeye Name:N4-isopentyl-5-nitro-N6-[2-(2-thienyl)ethyl]pyrimidine-4,6-diamine
CAS Name:N4-(3-methylbutyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
IUPAC Name:4-N-(3-methylbutyl)-5-nitro-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
Traditional Name:isoamyl-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]amine
Formula: C15H21N5O2S
MolecularWeight: 335.42454
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2


Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC=CS2


InChI

InChI=1S/C15H21N5O2S/c1-11(2)5-7-16-14-13(20(21)22)15(19-10-18-14)17-8-6-12-4-3-9-23-12/h3-4,9-11H,5-8H2,1-2H3,(H2,16,17,18,19)


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