N-(4-methylphenyl)sulfonyl-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanimidate

Systemtic Name: N-(4-methylphenyl)sulfonyl-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanimidate Openeye Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(p-tolylsulfonyl)ethanimidate CAS Name: N-(4-methylphenyl)sulfonyl-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]ethanimidate IUPAC Name: N-(4-methylphenyl)sulfonyl-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanimidate Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-N-tosyl-acetimidate Formula: C19H16N3O4S2- MolecularWeight: 414.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC(=O)C=C(N2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC(=O)C=C(N2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C19H17N3O4S2/c1-13-7-9-15(10-8-13)28(25,26)22-18(24)12-27-19-20-16(11-17(23)21-19)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,22,24)(H,20,21,23)/p-1