methyl 3-[3-(2-fluorophenyl)sulfanylpropanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-(2-fluorophenyl)sulfanylpropanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-(2-fluorophenyl)sulfanylpropanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-[(2-fluorophenyl)thio]-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(2-fluorophenyl)sulfanylpropanoylamino]-4-methylbenzoate Traditional Name: 3-[3-[(2-fluorophenyl)thio]propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C18H18FNO3S MolecularWeight: 347.403823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCSC2=CC=CC=C2F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCSC2=CC=CC=C2F

InChI

InChI=1S/C18H18FNO3S/c1-12-7-8-13(18(22)23-2)11-15(12)20-17(21)9-10-24-16-6-4-3-5-14(16)19/h3-8,11H,9-10H2,1-2H3,(H,20,21)