methyl 3-[2-(3-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-(3-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(3-chloro-4-fluoro-phenyl)sulfanylacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(3-chloro-4-fluorophenyl)thio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-chloro-4-fluorophenyl)sulfanylacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(3-chloro-4-fluoro-phenyl)thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C17H15ClFNO3S MolecularWeight: 367.822303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H15ClFNO3S/c1-10-3-4-11(17(22)23-2)7-15(10)20-16(21)9-24-12-5-6-14(19)13(18)8-12/h3-8H,9H2,1-2H3,(H,20,21)