methyl (2S)-2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C20H24N2O6S2 MolecularWeight: 452.54436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)N[C@@H](CCSC)C(=O)OC

InChI

InChI=1S/C20H24N2O6S2/c1-27-18-10-5-4-9-16(18)22-30(25,26)15-8-6-7-14(13-15)19(23)21-17(11-12-29-3)20(24)28-2/h4-10,13,17,22H,11-12H2,1-3H3,(H,21,23)/t17-/m0/s1