2-[(6-methyl-5-oxidanidyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonyl-ethanimidate

Systemtic Name: 2-[(6-methyl-5-oxidanidyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonyl-ethanimidate Openeye Name: 2-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)sulfanyl]-N-(p-tolylsulfonyl)ethanimidate CAS Name: 2-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)thio]-N-(4-methylphenyl)sulfonylethanimidate IUPAC Name: 2-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonylethanimidate Traditional Name: 2-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)thio]-N-tosyl-acetimidate Formula: C13H12N4O4S2-2 MolecularWeight: 352.38878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC(=C(N=N2)C)[O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC(=C(N=N2)C)[O-])[O-]

InChI

InChI=1S/C13H14N4O4S2/c1-8-3-5-10(6-4-8)23(20,21)17-11(18)7-22-13-14-12(19)9(2)15-16-13/h3-6H,7H2,1-2H3,(H,17,18)(H,14,16,19)/p-2