N,N-dimethyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyl-piperazine-1-sulfonamide Openeye Name: N,N-dimethyl-4-[2-(thiazol-4-ylmethylsulfanyl)benzoyl]piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[oxo-[2-(4-thiazolylmethylthio)phenyl]methyl]-1-piperazinesulfonamide IUPAC Name: N,N-dimethyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]piperazine-1-sulfonamide Traditional Name: N,N-dimethyl-4-[2-(thiazol-4-ylmethylthio)benzoyl]piperazine-1-sulfonamide Formula: C17H22N4O3S3 MolecularWeight: 426.57658

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SCC3=CSC=N3

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SCC3=CSC=N3

InChI

InChI=1S/C17H22N4O3S3/c1-19(2)27(23,24)21-9-7-20(8-10-21)17(22)15-5-3-4-6-16(15)26-12-14-11-25-13-18-14/h3-6,11,13H,7-10,12H2,1-2H3