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

Systemtic Name: methyl 3-(4-fluorophenyl)-2-[(4-methylphenyl)carbonylcarbamothioylamino]propanoate Openeye Name: methyl 3-(4-fluorophenyl)-2-[(4-methylbenzoyl)carbamothioylamino]propanoate CAS Name: 3-(4-fluorophenyl)-2-[[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-2-[(4-methylbenzoyl)carbamothioylamino]propanoate Traditional Name: 3-(4-fluorophenyl)-2-(p-toluoylthiocarbamoylamino)propionic acid methyl ester Formula: C19H19FN2O3S MolecularWeight: 374.429163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C19H19FN2O3S/c1-12-3-7-14(8-4-12)17(23)22-19(26)21-16(18(24)25-2)11-13-5-9-15(20)10-6-13/h3-10,16H,11H2,1-2H3,(H2,21,22,23,26)