ethyl 4-[2-(4-chlorophenyl)ethylcarbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-chlorophenyl)ethylcarbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-(4-chlorophenyl)ethylcarbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[[2-(4-chlorophenyl)ethylamino]-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-chlorophenyl)ethylcarbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[2-(4-chlorophenyl)ethylthiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C17H24ClN3O2S MolecularWeight: 369.90936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H24ClN3O2S/c1-2-23-17(22)21-11-8-15(9-12-21)20-16(24)19-10-7-13-3-5-14(18)6-4-13/h3-6,15H,2,7-12H2,1H3,(H2,19,20,24)