(2S)-3-methyl-2-[[7-[4-(2-methylpropyl)-1,2,3-triazol-1-yl]dibenzofuran-2-yl]sulfonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[7-[4-(2-methylpropyl)-1,2,3-triazol-1-yl]dibenzofuran-2-yl]sulfonylamino]butanoic acid Openeye Name: (2S)-2-[[7-(4-isobutyltriazol-1-yl)dibenzofuran-2-yl]sulfonylamino]-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[[7-[4-(2-methylpropyl)-1-triazolyl]-2-dibenzofuranyl]sulfonylamino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[7-[4-(2-methylpropyl)triazol-1-yl]dibenzofuran-2-yl]sulfonylamino]butanoic acid Traditional Name: (2S)-2-[[7-(4-isobutyltriazol-1-yl)dibenzofuran-2-yl]sulfonylamino]-3-methyl-butyric acid Formula: C23H26N4O5S MolecularWeight: 470.54134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN(N=N1)C2=CC3=C(C=C2)C4=C(O3)C=CC(=C4)S(=O)(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC(C)CC1=CN(N=N1)C2=CC3=C(C=C2)C4=C(O3)C=CC(=C4)S(=O)(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C23H26N4O5S/c1-13(2)9-15-12-27(26-24-15)16-5-7-18-19-11-17(6-8-20(19)32-21(18)10-16)33(30,31)25-22(14(3)4)23(28)29/h5-8,10-14,22,25H,9H2,1-4H3,(H,28,29)/t22-/m0/s1