2-[[4-[5-(5-ethylthiophen-2-yl)-1,2-oxazol-3-yl]phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-[5-(5-ethylthiophen-2-yl)-1,2-oxazol-3-yl]phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-[5-(5-ethyl-2-thienyl)isoxazol-3-yl]phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-[5-(5-ethyl-2-thiophenyl)-3-isoxazolyl]phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-[5-(5-ethylthiophen-2-yl)-1,2-oxazol-3-yl]phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[[4-[5-(5-ethyl-2-thienyl)isoxazol-3-yl]phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=CC(=NO2)C3=CC=C(C=C3)S(=O)(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C2=CC(=NO2)C3=CC=C(C=C3)S(=O)(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C20H22N2O5S2/c1-4-14-7-10-18(28-14)17-11-16(21-27-17)13-5-8-15(9-6-13)29(25,26)22-19(12(2)3)20(23)24/h5-12,19,22H,4H2,1-3H3,(H,23,24)