ethyl 2-[(2-chloranyl-4-methyl-phenyl)carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(2-chloranyl-4-methyl-phenyl)carbamothioylamino]hexanoate Openeye Name: ethyl 2-[(2-chloro-4-methyl-phenyl)carbamothioylamino]hexanoate CAS Name: 2-[[(2-chloro-4-methylanilino)-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-4-methylphenyl)carbamothioylamino]hexanoate Traditional Name: 2-[(2-chloro-4-methyl-phenyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C16H23ClN2O2S MolecularWeight: 342.88402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)NC(=S)NC1=C(C=C(C=C1)C)Cl

Isomeric SMILES

CCCCC(C(=O)OCC)NC(=S)NC1=C(C=C(C=C1)C)Cl

InChI

InChI=1S/C16H23ClN2O2S/c1-4-6-7-14(15(20)21-5-2)19-16(22)18-13-9-8-11(3)10-12(13)17/h8-10,14H,4-7H2,1-3H3,(H2,18,19,22)