(2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methyl-butanoic acid CAS Name: (2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(4-benzamidophenyl)sulfonylamino]-3-methyl-butyric acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O5S/c1-12(2)16(18(22)23)20-26(24,25)15-10-8-14(9-11-15)19-17(21)13-6-4-3-5-7-13/h3-12,16,20H,1-2H3,(H,19,21)(H,22,23)/t16-/m0/s1