N6-ethyl-2-methylsulfanyl-5-nitro-N4-propyl-pyrimidine-4,6-diamine

Systemtic Name: N6-ethyl-2-methylsulfanyl-5-nitro-N4-propyl-pyrimidine-4,6-diamine Openeye Name: N6-ethyl-2-methylsulfanyl-5-nitro-N4-propyl-pyrimidine-4,6-diamine CAS Name: N6-ethyl-2-(methylthio)-5-nitro-N4-propylpyrimidine-4,6-diamine IUPAC Name: 6-N-ethyl-2-methylsulfanyl-5-nitro-4-N-propylpyrimidine-4,6-diamine Traditional Name: ethyl-[2-(methylthio)-5-nitro-6-(propylamino)pyrimidin-4-yl]amine Formula: C10H17N5O2S MolecularWeight: 271.33928

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC(=C1[N+](=O)[O-])NCC)SC

Isomeric SMILES

CCCNC1=NC(=NC(=C1[N+](=O)[O-])NCC)SC

InChI

InChI=1S/C10H17N5O2S/c1-4-6-12-9-7(15(16)17)8(11-5-2)13-10(14-9)18-3/h4-6H2,1-3H3,(H2,11,12,13,14)