ethyl 2-[(2-chlorophenyl)carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(2-chlorophenyl)carbamothioylamino]hexanoate Openeye Name: ethyl 2-[(2-chlorophenyl)carbamothioylamino]hexanoate CAS Name: 2-[[(2-chloroanilino)-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-chlorophenyl)carbamothioylamino]hexanoate Traditional Name: 2-[(2-chlorophenyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C15H21ClN2O2S MolecularWeight: 328.85744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)NC(=S)NC1=CC=CC=C1Cl

Isomeric SMILES

CCCCC(C(=O)OCC)NC(=S)NC1=CC=CC=C1Cl

InChI

InChI=1S/C15H21ClN2O2S/c1-3-5-9-13(14(19)20-4-2)18-15(21)17-12-10-7-6-8-11(12)16/h6-8,10,13H,3-5,9H2,1-2H3,(H2,17,18,21)