ethyl 3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]butanoate

Systemtic Name: ethyl 3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]butanoate Openeye Name: ethyl 3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]butanoate CAS Name: 3-[[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]butanoate Traditional Name: 3-(homoveratrylthiocarbamoylamino)butyric acid ethyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)NC(=S)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC(=O)CC(C)NC(=S)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C17H26N2O4S/c1-5-23-16(20)10-12(2)19-17(24)18-9-8-13-6-7-14(21-3)15(11-13)22-4/h6-7,11-12H,5,8-10H2,1-4H3,(H2,18,19,24)