2-(4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)sulfonyl-ethanimidate

Systemtic Name: 2-(4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)sulfonyl-ethanimidate Openeye Name: 2-(4-methyl-6-oxido-pyrimidin-2-yl)sulfanyl-N-(p-tolylsulfonyl)ethanimidate CAS Name: 2-[(4-methyl-6-oxido-2-pyrimidinyl)thio]-N-(4-methylphenyl)sulfonylethanimidate IUPAC Name: 2-(4-methyl-6-oxidopyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)sulfonylethanimidate Traditional Name: 2-[(4-methyl-6-oxido-pyrimidin-2-yl)thio]-N-tosyl-acetimidate Formula: C14H13N3O4S2-2 MolecularWeight: 351.40072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4S2/c1-9-3-5-11(6-4-9)23(20,21)17-13(19)8-22-14-15-10(2)7-12(18)16-14/h3-7H,8H2,1-2H3,(H,17,19)(H,15,16,18)/p-2