3,4,5-trimethyl-2-[[(4-methyl-1,3-thiazol-2-yl)sulfonyl-propyl-amino]-phenoxy-methyl]benzoic acid

Systemtic Name: 3,4,5-trimethyl-2-[[(4-methyl-1,3-thiazol-2-yl)sulfonyl-propyl-amino]-phenoxy-methyl]benzoic acid Openeye Name: 3,4,5-trimethyl-2-[[(4-methylthiazol-2-yl)sulfonyl-propyl-amino]-phenoxy-methyl]benzoic acid CAS Name: 3,4,5-trimethyl-2-[[(4-methyl-2-thiazolyl)sulfonyl-propylamino]-phenoxymethyl]benzoic acid IUPAC Name: 3,4,5-trimethyl-2-[[(4-methyl-1,3-thiazol-2-yl)sulfonyl-propylamino]-phenoxymethyl]benzoic acid Traditional Name: 3,4,5-trimethyl-2-[[(4-methylthiazol-2-yl)sulfonyl-propyl-amino]-phenoxy-methyl]benzoic acid Formula: C24H28N2O5S2 MolecularWeight: 488.61952

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C1=C(C(=C(C=C1C(=O)O)C)C)C)OC2=CC=CC=C2)S(=O)(=O)C3=NC(=CS3)C

Isomeric SMILES

CCCN(C(C1=C(C(=C(C=C1C(=O)O)C)C)C)OC2=CC=CC=C2)S(=O)(=O)C3=NC(=CS3)C

InChI

InChI=1S/C24H28N2O5S2/c1-6-12-26(33(29,30)24-25-16(3)14-32-24)22(31-19-10-8-7-9-11-19)21-18(5)17(4)15(2)13-20(21)23(27)28/h7-11,13-14,22H,6,12H2,1-5H3,(H,27,28)