ethyl 2-methyl-3-[2-(phenylmethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[2-(phenylmethylsulfanyl)ethanoylamino]benzoate Openeye Name: ethyl 3-[(2-benzylsulfanylacetyl)amino]-2-methyl-benzoate CAS Name: 2-methyl-3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-benzylsulfanylacetyl)amino]-2-methylbenzoate Traditional Name: 3-[[2-(benzylthio)acetyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)NC(=O)CSCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)NC(=O)CSCC2=CC=CC=C2)C

InChI

InChI=1S/C19H21NO3S/c1-3-23-19(22)16-10-7-11-17(14(16)2)20-18(21)13-24-12-15-8-5-4-6-9-15/h4-11H,3,12-13H2,1-2H3,(H,20,21)