(E)-3-[4-[[4-[3-(4-chloranylbutoxy)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-bis(fluoranyl)phenyl]-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-[4-[[4-[3-(4-chloranylbutoxy)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-bis(fluoranyl)phenyl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[4-[[4-[3-(4-chlorobutoxy)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[4-[[[4-[3-(4-chlorobutoxy)-2-methoxyphenyl]-2-thiazolyl]amino]-oxomethyl]-2,6-difluorophenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[4-[[4-[3-(4-chlorobutoxy)-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-difluorophenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[4-[[4-[3-(4-chlorobutoxy)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-acrylic acid Formula: C25H23ClF2N2O5S MolecularWeight: 536.975326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C=C(C=C1F)C(=O)NC2=NC(=CS2)C3=C(C(=CC=C3)OCCCCCl)OC)F)C(=O)O

Isomeric SMILES

C/C(=C\C1=C(C=C(C=C1F)C(=O)NC2=NC(=CS2)C3=C(C(=CC=C3)OCCCCCl)OC)F)/C(=O)O

InChI

InChI=1S/C25H23ClF2N2O5S/c1-14(24(32)33)10-17-18(27)11-15(12-19(17)28)23(31)30-25-29-20(13-36-25)16-6-5-7-21(22(16)34-2)35-9-4-3-8-26/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,32,33)(H,29,30,31)/b14-10+