N-methyl-N-[2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-methyl-N-[2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-methyl-N-[2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-methyl-N-[2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-methyl-N-[2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-[2-keto-2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]piperazino]ethyl]-N-methyl-methanesulfonamide Formula: C16H22N4O3S3 MolecularWeight: 414.56588

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)SC)S(=O)(=O)C

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)SC)S(=O)(=O)C

InChI

InChI=1S/C16H22N4O3S3/c1-18(26(3,22)23)11-15(21)19-6-8-20(9-7-19)16-17-13-5-4-12(24-2)10-14(13)25-16/h4-5,10H,6-9,11H2,1-3H3