2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-oxidanyl-4-phenylmethoxy-phenyl)ethanone

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-oxidanyl-4-phenylmethoxy-phenyl)ethanone Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-benzyloxy-2-hydroxy-phenyl)ethanone CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-(2-hydroxy-4-phenylmethoxyphenyl)ethanone IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-hydroxy-4-phenylmethoxyphenyl)ethanone Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-1-(4-benzoxy-2-hydroxy-phenyl)ethanone Formula: C22H17NO3S2 MolecularWeight: 407.50528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4S3)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C22H17NO3S2/c24-19-12-16(26-13-15-6-2-1-3-7-15)10-11-17(19)20(25)14-27-22-23-18-8-4-5-9-21(18)28-22/h1-12,24H,13-14H2