3-(1,3-benzothiazol-2-ylsulfanyl)-N-(phenylmethyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(phenylmethyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-benzyl-propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(phenylmethyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-benzylpropane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-benzyl-propane-1-sulfonamide Formula: C17H18N2O2S3 MolecularWeight: 378.53202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N2O2S3/c20-24(21,18-13-14-7-2-1-3-8-14)12-6-11-22-17-19-15-9-4-5-10-16(15)23-17/h1-5,7-10,18H,6,11-13H2