ethyl 3-(4-phenylsulfanylbutanoylamino)benzoate

Systemtic Name: ethyl 3-(4-phenylsulfanylbutanoylamino)benzoate Openeye Name: ethyl 3-(4-phenylsulfanylbutanoylamino)benzoate CAS Name: 3-[[1-oxo-4-(phenylthio)butyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(4-phenylsulfanylbutanoylamino)benzoate Traditional Name: 3-[4-(phenylthio)butanoylamino]benzoic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-2-23-19(22)15-8-6-9-16(14-15)20-18(21)12-7-13-24-17-10-4-3-5-11-17/h3-6,8-11,14H,2,7,12-13H2,1H3,(H,20,21)