[3-[4-(4-chlorophenyl)phenyl]carbonyl-2-methyl-cyclopentyl]methyl pyrrolidine-1-carbodithioate

Systemtic Name: [3-[4-(4-chlorophenyl)phenyl]carbonyl-2-methyl-cyclopentyl]methyl pyrrolidine-1-carbodithioate Openeye Name: [3-[4-(4-chlorophenyl)benzoyl]-2-methyl-cyclopentyl]methyl pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [3-[[4-(4-chlorophenyl)phenyl]-oxomethyl]-2-methylcyclopentyl]methyl ester IUPAC Name: [3-[4-(4-chlorophenyl)benzoyl]-2-methylcyclopentyl]methyl pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [3-[4-(4-chlorophenyl)benzoyl]-2-methyl-cyclopentyl]methyl ester Formula: C25H28ClNOS2 MolecularWeight: 458.07892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC1C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Cl)CSC(=S)N4CCCC4

Isomeric SMILES

CC1C(CCC1C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Cl)CSC(=S)N4CCCC4

InChI

InChI=1S/C25H28ClNOS2/c1-17-21(16-30-25(29)27-14-2-3-15-27)10-13-23(17)24(28)20-6-4-18(5-7-20)19-8-11-22(26)12-9-19/h4-9,11-12,17,21,23H,2-3,10,13-16H2,1H3