N-[2-[2-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]methanesulfonamide

Systemtic Name: N-[2-[2-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]methanesulfonamide Openeye Name: N-[2-[2-(4-hydroxyphenyl)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]methanesulfonamide CAS Name: N-[2-[[2-(4-hydroxyphenyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]methanesulfonamide IUPAC Name: N-[2-[2-(4-hydroxyphenyl)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]methanesulfonamide Traditional Name: N-[2-[[2-(4-hydroxyphenyl)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]methanesulfonamide Formula: C16H14N2O4S3 MolecularWeight: 394.48836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)C3=CC=C(C=C3)O

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C16H14N2O4S3/c1-25(21,22)18-11-4-7-13-15(8-11)24-16(17-13)23-9-14(20)10-2-5-12(19)6-3-10/h2-8,18-19H,9H2,1H3