[2-(trifluoromethyl)phenyl] 2-(methanethioylamino)-3-phenyl-propanoate

Systemtic Name: [2-(trifluoromethyl)phenyl] 2-(methanethioylamino)-3-phenyl-propanoate Openeye Name: [2-(trifluoromethyl)phenyl] 2-(methanethioylamino)-3-phenyl-propanoate CAS Name: 2-(methanethioylamino)-3-phenylpropanoic acid [2-(trifluoromethyl)phenyl] ester IUPAC Name: [2-(trifluoromethyl)phenyl] 2-(methanethioylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-2-(thioformylamino)propionic acid [2-(trifluoromethyl)phenyl] ester Formula: C17H14F3NO2S MolecularWeight: 353.35877

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OC2=CC=CC=C2C(F)(F)F)NC=S

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OC2=CC=CC=C2C(F)(F)F)NC=S

InChI

InChI=1S/C17H14F3NO2S/c18-17(19,20)13-8-4-5-9-15(13)23-16(22)14(21-11-24)10-12-6-2-1-3-7-12/h1-9,11,14H,10H2,(H,21,24)