2-methyl-2-[4-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbamoylamino]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbamoylamino]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-[[4-(thiophene-2-carbonylamino)phenyl]carbamoylamino]phenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[[oxo-[4-[[oxo(thiophen-2-yl)methyl]amino]anilino]methyl]amino]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-[[4-(thiophene-2-carbonylamino)phenyl]carbamoylamino]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-[[4-(2-thenoylamino)phenyl]carbamoylamino]phenoxy]propionic acid Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H21N3O5S/c1-22(2,20(27)28)30-17-11-9-16(10-12-17)25-21(29)24-15-7-5-14(6-8-15)23-19(26)18-4-3-13-31-18/h3-13H,1-2H3,(H,23,26)(H,27,28)(H2,24,25,29)