ethyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate

Systemtic Name: ethyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate Openeye Name: ethyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate CAS Name: 3-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dimethoxyphenyl)carbamothioylamino]propanoate Traditional Name: 3-[(3,4-dimethoxyphenyl)thiocarbamoylamino]propionic acid ethyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)NC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC(=O)CCNC(=S)NC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C14H20N2O4S/c1-4-20-13(17)7-8-15-14(21)16-10-5-6-11(18-2)12(9-10)19-3/h5-6,9H,4,7-8H2,1-3H3,(H2,15,16,21)