methyl 4-methyl-3-[2-[(1R)-1-phenylethyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(1R)-1-phenylethyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[(1R)-1-phenylethyl]sulfanylacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[[(1R)-1-phenylethyl]thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[(1R)-1-phenylethyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[[(1R)-1-phenylethyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC(C)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CS[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-13-9-10-16(19(22)23-3)11-17(13)20-18(21)12-24-14(2)15-7-5-4-6-8-15/h4-11,14H,12H2,1-3H3,(H,20,21)/t14-/m1/s1