methyl 5-methyl-2-(2-propan-2-ylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 5-methyl-2-(2-propan-2-ylsulfanylethanoylamino)benzoate Openeye Name: methyl 2-[(2-isopropylsulfanylacetyl)amino]-5-methyl-benzoate CAS Name: 5-methyl-2-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(2-propan-2-ylsulfanylacetyl)amino]benzoate Traditional Name: 2-[[2-(isopropylthio)acetyl]amino]-5-methyl-benzoic acid methyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3S/c1-9(2)19-8-13(16)15-12-6-5-10(3)7-11(12)14(17)18-4/h5-7,9H,8H2,1-4H3,(H,15,16)