2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)ethanesulfonamide

Systemtic Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)ethanesulfonamide Openeye Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)ethanesulfonamide CAS Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(3-methoxyphenyl)ethanesulfonamide IUPAC Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)ethanesulfonamide Traditional Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(3-methoxyphenyl)ethanesulfonamide Formula: C17H18N2O4S3 MolecularWeight: 410.53082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)SCCS(=O)(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)SCCS(=O)(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C17H18N2O4S3/c1-22-13-5-3-4-12(10-13)19-26(20,21)9-8-24-17-18-15-7-6-14(23-2)11-16(15)25-17/h3-7,10-11,19H,8-9H2,1-2H3