ethyl 4-(2-propan-2-ylsulfanylethanoylamino)benzoate

Systemtic Name: ethyl 4-(2-propan-2-ylsulfanylethanoylamino)benzoate Openeye Name: ethyl 4-[(2-isopropylsulfanylacetyl)amino]benzoate CAS Name: 4-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-propan-2-ylsulfanylacetyl)amino]benzoate Traditional Name: 4-[[2-(isopropylthio)acetyl]amino]benzoic acid ethyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC(C)C

InChI

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