ethyl 3-oxidanylidene-4-[4-(2-phenylethanoylamino)phenyl]sulfanyl-butanoate

Systemtic Name: ethyl 3-oxidanylidene-4-[4-(2-phenylethanoylamino)phenyl]sulfanyl-butanoate Openeye Name: ethyl 3-oxo-4-[4-[(2-phenylacetyl)amino]phenyl]sulfanyl-butanoate CAS Name: 3-oxo-4-[[4-[(1-oxo-2-phenylethyl)amino]phenyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-[4-[(2-phenylacetyl)amino]phenyl]sulfanylbutanoate Traditional Name: 3-keto-4-[[4-[(2-phenylacetyl)amino]phenyl]thio]butyric acid ethyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H21NO4S/c1-2-25-20(24)13-17(22)14-26-18-10-8-16(9-11-18)21-19(23)12-15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3,(H,21,23)