4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonyl-N-ethyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonyl-N-ethyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonyl-N-benzyl-N-ethyl-benzenesulfonamide CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]sulfonyl]-N-ethyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]sulfonyl-N-benzyl-N-ethylbenzenesulfonamide Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)piperazino]sulfonyl-N-benzyl-N-ethyl-benzenesulfonamide Formula: C26H28N4O4S3 MolecularWeight: 556.71992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H28N4O4S3/c1-2-29(20-21-8-4-3-5-9-21)36(31,32)22-12-14-23(15-13-22)37(33,34)30-18-16-28(17-19-30)26-27-24-10-6-7-11-25(24)35-26/h3-15H,2,16-20H2,1H3