N-[3,4-bis(chloranyl)phenoxy]-3-bromanyl-3-(4-piperidin-1-ylcyclohexyl)carbonyl-2H-thiophene-5-sulfonamide

Systemtic Name: N-[3,4-bis(chloranyl)phenoxy]-3-bromanyl-3-(4-piperidin-1-ylcyclohexyl)carbonyl-2H-thiophene-5-sulfonamide Openeye Name: 3-bromo-N-(3,4-dichlorophenoxy)-3-[4-(1-piperidyl)cyclohexanecarbonyl]-2H-thiophene-5-sulfonamide CAS Name: 3-bromo-N-(3,4-dichlorophenoxy)-3-[oxo-[4-(1-piperidinyl)cyclohexyl]methyl]-2H-thiophene-5-sulfonamide IUPAC Name: 3-bromo-N-(3,4-dichlorophenoxy)-3-(4-piperidin-1-ylcyclohexanecarbonyl)-2H-thiophene-5-sulfonamide Traditional Name: 3-bromo-N-(3,4-dichlorophenoxy)-3-(4-piperidinocyclohexanecarbonyl)-2H-thiophene-5-sulfonamide Formula: C22H27BrCl2N2O4S2 MolecularWeight: 598.40078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCC(CC2)C(=O)C3(CSC(=C3)S(=O)(=O)NOC4=CC(=C(C=C4)Cl)Cl)Br

Isomeric SMILES

C1CCN(CC1)C2CCC(CC2)C(=O)C3(CSC(=C3)S(=O)(=O)NOC4=CC(=C(C=C4)Cl)Cl)Br

InChI

InChI=1S/C22H27BrCl2N2O4S2/c23-22(21(28)15-4-6-16(7-5-15)27-10-2-1-3-11-27)13-20(32-14-22)33(29,30)26-31-17-8-9-18(24)19(25)12-17/h8-9,12-13,15-16,26H,1-7,10-11,14H2