3-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloranyl-2-methoxy-phenyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloranyl-2-methoxy-phenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloro-2-methoxy-phenyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(5-chloro-2-methoxyphenyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloro-2-methoxyphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(5-chloro-2-methoxy-phenyl)propane-1-sulfonamide Formula: C17H17ClN2O3S3 MolecularWeight: 428.97648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H17ClN2O3S3/c1-23-15-8-7-12(18)11-14(15)20-26(21,22)10-4-9-24-17-19-13-5-2-3-6-16(13)25-17/h2-3,5-8,11,20H,4,9-10H2,1H3