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

Systemtic Name: 2-[[4-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-[5-(4-methoxyphenyl)thiazol-2-yl]phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-[5-(4-methoxyphenyl)-2-thiazolyl]phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[[4-[5-(4-methoxyphenyl)thiazol-2-yl]phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=NC=C(S2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=NC=C(S2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O5S2/c1-13(2)19(21(24)25)23-30(26,27)17-10-6-15(7-11-17)20-22-12-18(29-20)14-4-8-16(28-3)9-5-14/h4-13,19,23H,1-3H3,(H,24,25)