ethyl 2-[(3,4-dichlorophenyl)methylcarbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(3,4-dichlorophenyl)methylcarbamothioylamino]hexanoate Openeye Name: ethyl 2-[(3,4-dichlorophenyl)methylcarbamothioylamino]hexanoate CAS Name: 2-[[[(3,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(3,4-dichlorophenyl)methylcarbamothioylamino]hexanoate Traditional Name: 2-[(3,4-dichlorobenzyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C16H22Cl2N2O2S MolecularWeight: 377.32908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)NC(=S)NCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCC(C(=O)OCC)NC(=S)NCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H22Cl2N2O2S/c1-3-5-6-14(15(21)22-4-2)20-16(23)19-10-11-7-8-12(17)13(18)9-11/h7-9,14H,3-6,10H2,1-2H3,(H2,19,20,23)