3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide

Systemtic Name: 3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide Openeye Name: 3-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-N-cyclohexyl-N-methyl-benzenesulfonamide CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-N-cyclohexyl-N-methylbenzenesulfonamide IUPAC Name: 3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-N-methylbenzenesulfonamide Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)piperidino]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide Formula: C25H31N3O4S3 MolecularWeight: 533.72634

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H31N3O4S3/c1-27(20-8-3-2-4-9-20)34(29,30)21-10-7-11-22(18-21)35(31,32)28-16-14-19(15-17-28)25-26-23-12-5-6-13-24(23)33-25/h5-7,10-13,18-20H,2-4,8-9,14-17H2,1H3