2-(3,4-dichlorophenyl)-N-(3,3-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl)-N-methyl-ethanethioamide

Systemtic Name: 2-(3,4-dichlorophenyl)-N-(3,3-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl)-N-methyl-ethanethioamide Openeye Name: 2-(3,4-dichlorophenyl)-N-(3,3-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl)-N-methyl-thioacetamide CAS Name: 2-(3,4-dichlorophenyl)-N-[3,3-dimethoxy-2-(1-pyrrolidinyl)cyclohexyl]-N-methylethanethioamide IUPAC Name: 2-(3,4-dichlorophenyl)-N-(3,3-dimethoxy-2-pyrrolidin-1-ylcyclohexyl)-N-methylethanethioamide Traditional Name: 2-(3,4-dichlorophenyl)-N-(3,3-dimethoxy-2-pyrrolidino-cyclohexyl)-N-methyl-thioacetamide Formula: C21H30Cl2N2O2S MolecularWeight: 445.4461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC(C1N2CCCC2)(OC)OC)C(=S)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C1CCCC(C1N2CCCC2)(OC)OC)C(=S)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H30Cl2N2O2S/c1-24(19(28)14-15-8-9-16(22)17(23)13-15)18-7-6-10-21(26-2,27-3)20(18)25-11-4-5-12-25/h8-9,13,18,20H,4-7,10-12,14H2,1-3H3