N-[6-(3-oxidanylidenepiperazin-1-yl)carbonyl-1,3-benzothiazol-2-yl]methanesulfonamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)carbonyl-1,3-benzothiazol-2-yl]methanesulfonamide Openeye Name: N-[6-(3-oxopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]methanesulfonamide CAS Name: N-[6-[oxo-(3-oxo-1-piperazinyl)methyl]-1,3-benzothiazol-2-yl]methanesulfonamide IUPAC Name: N-[6-(3-oxopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]methanesulfonamide Traditional Name: N-[6-(3-ketopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]methanesulfonamide Formula: C13H14N4O4S2 MolecularWeight: 354.40466

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCNC(=O)C3

Isomeric SMILES

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCNC(=O)C3

InChI

InChI=1S/C13H14N4O4S2/c1-23(20,21)16-13-15-9-3-2-8(6-10(9)22-13)12(19)17-5-4-14-11(18)7-17/h2-3,6H,4-5,7H2,1H3,(H,14,18)(H,15,16)