N-[5-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-4-oxidanyl-phenyl]ethanesulfonamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-4-oxidanyl-phenyl]ethanesulfonamide Openeye Name: N-[5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-2-methyl-phenyl]ethanesulfonamide CAS Name: N-[5-(1,3-benzothiazol-2-ylthio)-4-hydroxy-2-methylphenyl]ethanesulfonamide IUPAC Name: N-[5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-2-methylphenyl]ethanesulfonamide Traditional Name: N-[5-(1,3-benzothiazol-2-ylthio)-4-hydroxy-2-methyl-phenyl]ethanesulfonamide Formula: C16H16N2O3S3 MolecularWeight: 380.50484

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC(=C(C=C1C)O)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCS(=O)(=O)NC1=CC(=C(C=C1C)O)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H16N2O3S3/c1-3-24(20,21)18-12-9-15(13(19)8-10(12)2)23-16-17-11-6-4-5-7-14(11)22-16/h4-9,18-19H,3H2,1-2H3