ethyl 2-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]hexanoate Openeye Name: ethyl 2-[(5-chloro-2-methoxy-phenyl)carbamothioylamino]hexanoate CAS Name: 2-[[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-2-methoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 2-[(5-chloro-2-methoxy-phenyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C16H23ClN2O3S MolecularWeight: 358.88342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23ClN2O3S/c1-4-6-7-12(15(20)22-5-2)18-16(23)19-13-10-11(17)8-9-14(13)21-3/h8-10,12H,4-7H2,1-3H3,(H2,18,19,23)