3-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)propane-1-sulfonamide

Systemtic Name: 3-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)propane-1-sulfonamide Openeye Name: 3-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(o-tolyl)propane-1-sulfonamide CAS Name: 3-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(2-methylphenyl)-1-propanesulfonamide IUPAC Name: 3-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)propane-1-sulfonamide Traditional Name: 3-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(o-tolyl)propane-1-sulfonamide Formula: C18H20N2O3S3 MolecularWeight: 408.558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)CCCSC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)CCCSC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C18H20N2O3S3/c1-13-6-3-4-7-15(13)20-26(21,22)11-5-10-24-18-19-16-9-8-14(23-2)12-17(16)25-18/h3-4,6-9,12,20H,5,10-11H2,1-2H3