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

Systemtic Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide; ethanedioic acid Openeye Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide; oxalic acid CAS Name: 3-[(3,4-dichlorophenyl)thio]-N-(2-diethylaminoethyl)-1-pyrrolidinecarboxamide; oxalic acid IUPAC Name: 3-(3,4-dichlorophenyl)sulfanyl-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide; oxalic acid Traditional Name: 3-[(3,4-dichlorophenyl)thio]-N-(2-diethylaminoethyl)pyrrolidine-1-carboxamide; oxalic acid Formula: C19H27Cl2N3O5S MolecularWeight: 480.40578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25Cl2N3OS.C2H2O4/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;3-1(4)2(5)6/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,20,23);(H,3,4)(H,5,6)