2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonyl-ethanimidate

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonyl-ethanimidate Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(p-tolylsulfonyl)ethanimidate CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-(4-methylphenyl)sulfonylethanimidate IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonylethanimidate Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-tosyl-acetimidate Formula: C16H14N3O3S2- MolecularWeight: 360.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC3=CC=CC=C3N2)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(CSC2=NC3=CC=CC=C3N2)[O-]

InChI

InChI=1S/C16H15N3O3S2/c1-11-6-8-12(9-7-11)24(21,22)19-15(20)10-23-16-17-13-4-2-3-5-14(13)18-16/h2-9H,10H2,1H3,(H,17,18)(H,19,20)/p-1