ethyl 4-[(3-chlorophenyl)carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3-chlorophenyl)carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3-chlorophenyl)carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[(3-chloroanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-chlorophenyl)carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[(3-chlorophenyl)thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C15H20ClN3O2S MolecularWeight: 341.8562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H20ClN3O2S/c1-2-21-15(20)19-8-6-12(7-9-19)17-14(22)18-13-5-3-4-11(16)10-13/h3-5,10,12H,2,6-9H2,1H3,(H2,17,18,22)