3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide

Systemtic Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide Openeye Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide CAS Name: 3-[(3,4-dichlorophenyl)thio]-N-(2-diethylaminoethyl)-1-pyrrolidinecarboxamide IUPAC Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide Traditional Name: 3-[(3,4-dichlorophenyl)thio]-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide Formula: C17H25Cl2N3OS MolecularWeight: 390.3709

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)N1CCC(C1)SC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCN(CC)CCNC(=O)N1CCC(C1)SC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H25Cl2N3OS/c1-3-21(4-2)10-8-20-17(23)22-9-7-14(12-22)24-13-5-6-15(18)16(19)11-13/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,20,23)