N-[2-(4-methylphenyl)sulfanylethyl]-2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)oxy]ethanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-[(5-nitro-6-oxidanylidene-1H-pyrimidin-4-yl)oxy]ethanamide Openeye Name: 2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]acetamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-[(5-nitro-6-oxo-1H-pyrimidin-4-yl)oxy]acetamide Traditional Name: 2-[(6-keto-5-nitro-1H-pyrimidin-4-yl)oxy]-N-[2-(p-tolylthio)ethyl]acetamide Formula: C15H16N4O5S MolecularWeight: 364.37634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O5S/c1-10-2-4-11(5-3-10)25-7-6-16-12(20)8-24-15-13(19(22)23)14(21)17-9-18-15/h2-5,9H,6-8H2,1H3,(H,16,20)(H,17,18,21)