methyl 3-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(2-chlorophenyl)methylthio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(2-chlorobenzyl)thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=CC=C2Cl

InChI

InChI=1S/C18H18ClNO3S/c1-12-7-8-13(18(22)23-2)9-16(12)20-17(21)11-24-10-14-5-3-4-6-15(14)19/h3-9H,10-11H2,1-2H3,(H,20,21)