propyl 4-(3-methylsulfanylpropanoylamino)benzoate

Systemtic Name: propyl 4-(3-methylsulfanylpropanoylamino)benzoate Openeye Name: propyl 4-(3-methylsulfanylpropanoylamino)benzoate CAS Name: 4-[[3-(methylthio)-1-oxopropyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-(3-methylsulfanylpropanoylamino)benzoate Traditional Name: 4-[3-(methylthio)propanoylamino]benzoic acid propyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC

InChI

InChI=1S/C14H19NO3S/c1-3-9-18-14(17)11-4-6-12(7-5-11)15-13(16)8-10-19-2/h4-7H,3,8-10H2,1-2H3,(H,15,16)