ethyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioylamino]hexanoate Openeye Name: ethyl 2-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioylamino]hexanoate CAS Name: 2-[[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-2,5-dimethoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 2-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C17H25ClN2O4S MolecularWeight: 388.9094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)NC(=S)NC1=CC(=C(C=C1OC)Cl)OC

Isomeric SMILES

CCCCC(C(=O)OCC)NC(=S)NC1=CC(=C(C=C1OC)Cl)OC

InChI

InChI=1S/C17H25ClN2O4S/c1-5-7-8-12(16(21)24-6-2)19-17(25)20-13-10-14(22-3)11(18)9-15(13)23-4/h9-10,12H,5-8H2,1-4H3,(H2,19,20,25)