2-[(E)-2-(4-methoxyphenyl)sulfonylsulfanylethenyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(E)-2-(4-methoxyphenyl)sulfonylsulfanylethenyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(E)-2-(4-methoxyphenyl)sulfonylsulfanylvinyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(E)-2-[(4-methoxyphenyl)sulfonylthio]ethenyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(E)-2-(4-methoxyphenyl)sulfonylsulfanylethenyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[(E)-2-[(4-methoxyphenyl)sulfonylthio]vinyl]-1,2-benzothiazol-3-one Formula: C16H13NO6S3 MolecularWeight: 411.47252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)SC=CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)S/C=C/N2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H13NO6S3/c1-23-12-6-8-13(9-7-12)26(21,22)24-11-10-17-16(18)14-4-2-3-5-15(14)25(17,19)20/h2-11H,1H3/b11-10+