methyl (2S)-2-[[5-(2-chlorophenyl)furan-2-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[[5-(2-chlorophenyl)furan-2-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[5-(2-chlorophenyl)-2-furanyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[5-(2-chlorophenyl)-2-furoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C17H18ClNO4S MolecularWeight: 367.84712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC=C(O1)C2=CC=CC=C2Cl

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)C1=CC=C(O1)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H18ClNO4S/c1-22-17(21)13(9-10-24-2)19-16(20)15-8-7-14(23-15)11-5-3-4-6-12(11)18/h3-8,13H,9-10H2,1-2H3,(H,19,20)/t13-/m0/s1