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

Systemtic Name: 2-(3,4-dichlorophenyl)-N-methyl-N-(3-methylsulfanyl-2-pyrrolidin-1-yl-cycloheptyl)ethanamide Openeye Name: 2-(3,4-dichlorophenyl)-N-methyl-N-(3-methylsulfanyl-2-pyrrolidin-1-yl-cycloheptyl)acetamide CAS Name: 2-(3,4-dichlorophenyl)-N-methyl-N-[3-(methylthio)-2-(1-pyrrolidinyl)cycloheptyl]acetamide IUPAC Name: 2-(3,4-dichlorophenyl)-N-methyl-N-(3-methylsulfanyl-2-pyrrolidin-1-ylcycloheptyl)acetamide Traditional Name: 2-(3,4-dichlorophenyl)-N-methyl-N-[3-(methylthio)-2-pyrrolidino-cycloheptyl]acetamide Formula: C21H30Cl2N2OS MolecularWeight: 429.4467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30Cl2N2OS/c1-24(20(26)14-15-9-10-16(22)17(23)13-15)18-7-3-4-8-19(27-2)21(18)25-11-5-6-12-25/h9-10,13,18-19,21H,3-8,11-12,14H2,1-2H3