methyl 3-(4-fluorophenyl)-2-[(4-methoxyphenyl)carbonylcarbamothioylamino]propanoate

Systemtic Name: methyl 3-(4-fluorophenyl)-2-[(4-methoxyphenyl)carbonylcarbamothioylamino]propanoate Openeye Name: methyl 3-(4-fluorophenyl)-2-[(4-methoxybenzoyl)carbamothioylamino]propanoate CAS Name: 3-(4-fluorophenyl)-2-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-2-[(4-methoxybenzoyl)carbamothioylamino]propanoate Traditional Name: 3-(4-fluorophenyl)-2-(p-anisoylthiocarbamoylamino)propionic acid methyl ester Formula: C19H19FN2O4S MolecularWeight: 390.428563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C19H19FN2O4S/c1-25-15-9-5-13(6-10-15)17(23)22-19(27)21-16(18(24)26-2)11-12-3-7-14(20)8-4-12/h3-10,16H,11H2,1-2H3,(H2,21,22,23,27)