4-(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-N-cyclohexyl-N-methyl-piperazine-1-sulfonamide

Systemtic Name: 4-(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-N-cyclohexyl-N-methyl-piperazine-1-sulfonamide Openeye Name: 4-(2-chloro-5-methylsulfanyl-benzoyl)-N-cyclohexyl-N-methyl-piperazine-1-sulfonamide CAS Name: 4-[[2-chloro-5-(methylthio)phenyl]-oxomethyl]-N-cyclohexyl-N-methyl-1-piperazinesulfonamide IUPAC Name: 4-(2-chloro-5-methylsulfanylbenzoyl)-N-cyclohexyl-N-methylpiperazine-1-sulfonamide Traditional Name: 4-[2-chloro-5-(methylthio)benzoyl]-N-cyclohexyl-N-methyl-piperazine-1-sulfonamide Formula: C19H28ClN3O3S2 MolecularWeight: 446.02692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C19H28ClN3O3S2/c1-21(15-6-4-3-5-7-15)28(25,26)23-12-10-22(11-13-23)19(24)17-14-16(27-2)8-9-18(17)20/h8-9,14-15H,3-7,10-13H2,1-2H3