methyl 2-[(2-fluorophenyl)-methanethioyl-amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(2-fluorophenyl)-methanethioyl-amino]-3-phenyl-propanoate Openeye Name: methyl 2-(2-fluoro-N-methanethioyl-anilino)-3-phenyl-propanoate CAS Name: 2-(2-fluoro-N-methanethioylanilino)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-(2-fluoro-N-methanethioylanilino)-3-phenylpropanoate Traditional Name: 2-(2-fluoro-N-thioformyl-anilino)-3-phenyl-propionic acid methyl ester Formula: C17H16FNO2S MolecularWeight: 317.377843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)N(C=S)C2=CC=CC=C2F

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)N(C=S)C2=CC=CC=C2F

InChI

InChI=1S/C17H16FNO2S/c1-21-17(20)16(11-13-7-3-2-4-8-13)19(12-22)15-10-6-5-9-14(15)18/h2-10,12,16H,11H2,1H3