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

Systemtic Name: methyl 2-[(2-fluorophenyl)carbothioylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 2-[(2-fluorobenzenecarbothioyl)amino]-3-(p-tolyl)propanoate CAS Name: 2-[[(2-fluorophenyl)-sulfanylidenemethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2-fluorobenzenecarbothioyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: 2-[(2-fluorothiobenzoyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C18H18FNO2S MolecularWeight: 331.404423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FNO2S/c1-12-7-9-13(10-8-12)11-16(18(21)22-2)20-17(23)14-5-3-4-6-15(14)19/h3-10,16H,11H2,1-2H3,(H,20,23)