N,N-diethyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N,N-diethyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N,N-diethyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide CAS Name: N,N-diethyl-2-(methylthio)-1,3-benzothiazole-6-sulfonamide IUPAC Name: N,N-diethyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N,N-diethyl-2-(methylthio)-1,3-benzothiazole-6-sulfonamide Formula: C12H16N2O2S3 MolecularWeight: 316.46264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC

InChI

InChI=1S/C12H16N2O2S3/c1-4-14(5-2)19(15,16)9-6-7-10-11(8-9)18-12(13-10)17-3/h6-8H,4-5H2,1-3H3