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

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(naphthalen-1-ylmethyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(1-naphthylmethyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(1-naphthalenylmethyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(naphthalen-1-ylmethyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(1-naphthylmethyl)propane-1-sulfonamide Formula: C21H20N2O2S3 MolecularWeight: 428.5907

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CNS(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CNS(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2O2S3/c24-28(25,22-15-17-9-5-8-16-7-1-2-10-18(16)17)14-6-13-26-21-23-19-11-3-4-12-20(19)27-21/h1-5,7-12,22H,6,13-15H2