2-[2-(4-chlorophenyl)ethylcarbamothioyl]-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide

Systemtic Name: 2-[2-(4-chlorophenyl)ethylcarbamothioyl]-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide Openeye Name: 2-[2-(4-chlorophenyl)ethylcarbamothioyl]-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide CAS Name: 2-[[2-(4-chlorophenyl)ethylamino]-sulfanylidenemethyl]-N-(2,6-diethylphenyl)-1-pyrazolidinecarboxamide IUPAC Name: 2-[2-(4-chlorophenyl)ethylcarbamothioyl]-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide Traditional Name: 2-[2-(4-chlorophenyl)ethylthiocarbamoyl]-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide Formula: C23H29ClN4OS MolecularWeight: 445.02056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H29ClN4OS/c1-3-18-7-5-8-19(4-2)21(18)26-22(29)27-15-6-16-28(27)23(30)25-14-13-17-9-11-20(24)12-10-17/h5,7-12H,3-4,6,13-16H2,1-2H3,(H,25,30)(H,26,29)