N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cycloheptyl]-2-(3,4-dichlorophenyl)-N-methyl-ethanamide

Systemtic Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cycloheptyl]-2-(3,4-dichlorophenyl)-N-methyl-ethanamide Openeye Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cycloheptyl]-2-(3,4-dichlorophenyl)-N-methyl-acetamide CAS Name: N-[3,3-bis(methylthio)-2-(1-pyrrolidinyl)cycloheptyl]-2-(3,4-dichlorophenyl)-N-methylacetamide IUPAC Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-ylcycloheptyl]-2-(3,4-dichlorophenyl)-N-methylacetamide Traditional Name: N-[3,3-bis(methylthio)-2-pyrrolidino-cycloheptyl]-2-(3,4-dichlorophenyl)-N-methyl-acetamide Formula: C22H32Cl2N2OS2 MolecularWeight: 475.53828

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC(C1N2CCCC2)(SC)SC)C(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C1CCCCC(C1N2CCCC2)(SC)SC)C(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H32Cl2N2OS2/c1-25(20(27)15-16-9-10-17(23)18(24)14-16)19-8-4-5-11-22(28-2,29-3)21(19)26-12-6-7-13-26/h9-10,14,19,21H,4-8,11-13,15H2,1-3H3