(E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-2-oxoethyl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-2-oxoethyl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-2-keto-ethyl]-2-phenyl-ethenesulfonamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CNS(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CNS(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S2/c27-22(16-23-31(28,29)15-10-18-6-2-1-3-7-18)26-13-11-25(12-14-26)17-21-24-19-8-4-5-9-20(19)30-21/h1-10,15,23H,11-14,16-17H2/b15-10+