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

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-phenylpropyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-phenylpropyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-phenylpropyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-phenylpropyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-phenylpropyl)propane-1-sulfonamide Formula: C19H22N2O2S3 MolecularWeight: 406.58518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2S3/c22-26(23,20-13-6-10-16-8-2-1-3-9-16)15-7-14-24-19-21-17-11-4-5-12-18(17)25-19/h1-5,8-9,11-12,20H,6-7,10,13-15H2