(E)-3-[4-[[4-[3-(cyclohexylmethoxymethyl)-2-fluoranyl-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-(cyclohexylmethoxymethyl)-2-fluoranyl-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-(cyclohexylmethoxymethyl)-2-fluoro-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[4-[[[4-[3-(cyclohexylmethoxymethyl)-2-fluorophenyl]-2-thiazolyl]amino]-oxomethyl]-2,6-difluorophenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[4-[[4-[3-(cyclohexylmethoxymethyl)-2-fluorophenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-difluorophenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[4-[[4-[3-(cyclohexylmethoxymethyl)-2-fluoro-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-acrylic acid Formula: C28H27F3N2O4S MolecularWeight: 544.58519

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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)COCC4CCCCC4)F)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)COCC4CCCCC4)F)F)/C(=O)O

InChI

InChI=1S/C28H27F3N2O4S/c1-16(27(35)36)10-21-22(29)11-19(12-23(21)30)26(34)33-28-32-24(15-38-28)20-9-5-8-18(25(20)31)14-37-13-17-6-3-2-4-7-17/h5,8-12,15,17H,2-4,6-7,13-14H2,1H3,(H,35,36)(H,32,33,34)/b16-10+