N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]phenyl]benzenesulfonamide

Systemtic Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]phenyl]benzenesulfonamide Openeye Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl]phenyl]benzenesulfonamide CAS Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]phenyl]benzenesulfonamide IUPAC Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl]phenyl]benzenesulfonamide Traditional Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]acetyl]phenyl]benzenesulfonamide Formula: C23H20N2O4S3 MolecularWeight: 484.6109

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S3/c1-2-29-18-12-13-20-22(14-18)31-23(24-20)30-15-21(26)16-8-10-17(11-9-16)25-32(27,28)19-6-4-3-5-7-19/h3-14,25H,2,15H2,1H3