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

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethyl-propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethyl-propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-phenethyl-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethylpropane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-phenethyl-propane-1-sulfonamide Formula: C18H20N2O2S3 MolecularWeight: 392.5586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O2S3/c21-25(22,19-12-11-15-7-2-1-3-8-15)14-6-13-23-18-20-16-9-4-5-10-17(16)24-18/h1-5,7-10,19H,6,11-14H2