methyl 3-(4-aminophenyl)-2-[(2-fluorophenyl)carbothioylamino]propanoate

Systemtic Name: methyl 3-(4-aminophenyl)-2-[(2-fluorophenyl)carbothioylamino]propanoate Openeye Name: methyl 3-(4-aminophenyl)-2-[(2-fluorobenzenecarbothioyl)amino]propanoate CAS Name: 3-(4-aminophenyl)-2-[[(2-fluorophenyl)-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-aminophenyl)-2-[(2-fluorobenzenecarbothioyl)amino]propanoate Traditional Name: 3-(4-aminophenyl)-2-[(2-fluorothiobenzoyl)amino]propionic acid methyl ester Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN2O2S/c1-22-17(21)15(10-11-6-8-12(19)9-7-11)20-16(23)13-4-2-3-5-14(13)18/h2-9,15H,10,19H2,1H3,(H,20,23)