4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-2,5-diethoxy-N-methyl-benzenesulfonamide

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-2,5-diethoxy-N-methyl-benzenesulfonamide Openeye Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-N-cyclohexyl-2,5-diethoxy-N-methyl-benzenesulfonamide CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-N-cyclohexyl-2,5-diethoxy-N-methylbenzenesulfonamide IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N-cyclohexyl-2,5-diethoxy-N-methylbenzenesulfonamide Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)piperidino]sulfonyl-N-cyclohexyl-2,5-diethoxy-N-methyl-benzenesulfonamide Formula: C29H39N3O6S3 MolecularWeight: 621.83146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1S(=O)(=O)N(C)C2CCCCC2)OCC)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC1=CC(=C(C=C1S(=O)(=O)N(C)C2CCCCC2)OCC)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C29H39N3O6S3/c1-4-37-24-20-28(25(38-5-2)19-27(24)40(33,34)31(3)22-11-7-6-8-12-22)41(35,36)32-17-15-21(16-18-32)29-30-23-13-9-10-14-26(23)39-29/h9-10,13-14,19-22H,4-8,11-12,15-18H2,1-3H3