ethyl 4-(4-phenylsulfanylbutanoylamino)benzoate

Systemtic Name: ethyl 4-(4-phenylsulfanylbutanoylamino)benzoate Openeye Name: ethyl 4-(4-phenylsulfanylbutanoylamino)benzoate CAS Name: 4-[[1-oxo-4-(phenylthio)butyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-phenylsulfanylbutanoylamino)benzoate Traditional Name: 4-[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=C(C=C1)NC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

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

InChI

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