N,N-dimethyl-2-(phenylmethylsulfanyl)-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N,N-dimethyl-2-(phenylmethylsulfanyl)-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-benzylsulfanyl-N,N-dimethyl-1,3-benzothiazole-6-sulfonamide CAS Name: N,N-dimethyl-2-(phenylmethylthio)-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-benzylsulfanyl-N,N-dimethyl-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-(benzylthio)-N,N-dimethyl-1,3-benzothiazole-6-sulfonamide Formula: C16H16N2O2S3 MolecularWeight: 364.50544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H16N2O2S3/c1-18(2)23(19,20)13-8-9-14-15(10-13)22-16(17-14)21-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3