ethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]hexanoate

Systemtic Name: ethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]hexanoate Openeye Name: ethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]hexanoate CAS Name: 2-[[(2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 2-[(2,5-dimethoxyphenyl)thiocarbamoylamino]hexanoic acid ethyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4S/c1-5-7-8-13(16(20)23-6-2)18-17(24)19-14-11-12(21-3)9-10-15(14)22-4/h9-11,13H,5-8H2,1-4H3,(H2,18,19,24)