methyl 2-[(4-iodanyl-2-phenyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-iodanyl-2-phenyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-iodo-2-phenyl-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-iodo-2-phenylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-iodo-2-phenylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-iodo-2-phenyl-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C19H20INO3S MolecularWeight: 469.33647

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)I)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)I)C2=CC=CC=C2

InChI

InChI=1S/C19H20INO3S/c1-24-19(23)17(10-11-25-2)21-18(22)15-9-8-14(20)12-16(15)13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3,(H,21,22)