methyl 3-(2-butylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 3-(2-butylsulfanylethanoylamino)benzoate Openeye Name: methyl 3-[(2-butylsulfanylacetyl)amino]benzoate CAS Name: 3-[[2-(butylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-butylsulfanylacetyl)amino]benzoate Traditional Name: 3-[[2-(butylthio)acetyl]amino]benzoic acid methyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=CC=CC(=C1)C(=O)OC

Isomeric SMILES

CCCCSCC(=O)NC1=CC=CC(=C1)C(=O)OC

InChI

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