4-[[4,5-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfonyl-prop-2-enyl-amino]phenoxy]methyl]-3-methyl-benzoic acid

Systemtic Name: 4-[[4,5-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfonyl-prop-2-enyl-amino]phenoxy]methyl]-3-methyl-benzoic acid Openeye Name: 4-[[2-[allyl-(4-methylthiazol-2-yl)sulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]-3-methyl-benzoic acid CAS Name: 4-[[4,5-dimethyl-2-[(4-methyl-2-thiazolyl)sulfonyl-prop-2-enylamino]phenoxy]methyl]-3-methylbenzoic acid IUPAC Name: 4-[[4,5-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfonyl-prop-2-enylamino]phenoxy]methyl]-3-methylbenzoic acid Traditional Name: 4-[[2-[allyl-(4-methylthiazol-2-yl)sulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]-3-methyl-benzoic acid Formula: C24H26N2O5S2 MolecularWeight: 486.60364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OCC2=C(C=C(C=C2)C(=O)O)C)N(CC=C)S(=O)(=O)C3=NC(=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)OCC2=C(C=C(C=C2)C(=O)O)C)N(CC=C)S(=O)(=O)C3=NC(=CS3)C

InChI

InChI=1S/C24H26N2O5S2/c1-6-9-26(33(29,30)24-25-18(5)14-32-24)21-11-15(2)16(3)12-22(21)31-13-20-8-7-19(23(27)28)10-17(20)4/h6-8,10-12,14H,1,9,13H2,2-5H3,(H,27,28)