(2-benzamido-2-oxidanylidene-ethyl) 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]acetate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]acetic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]acetate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]acetic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H21NO6S/c1-14(23)16-8-9-18(27-2)17(10-16)12-29-13-20(25)28-11-19(24)22-21(26)15-6-4-3-5-7-15/h3-10H,11-13H2,1-2H3,(H,22,24,26)