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

Systemtic Name: (E)-3-[2,6-bis(fluoranyl)-4-[[4-[2-fluoranyl-3-(3-methoxy-3-methyl-butyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(3-methoxy-3-methyl-butyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-difluoro-4-[[[4-[2-fluoro-3-(3-methoxy-3-methylbutyl)phenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(3-methoxy-3-methylbutyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(3-methoxy-3-methyl-butyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C26H25F3N2O4S MolecularWeight: 518.54791

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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)CCC(C)(C)OC)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)CCC(C)(C)OC)F)F)/C(=O)O

InChI

InChI=1S/C26H25F3N2O4S/c1-14(24(33)34)10-18-19(27)11-16(12-20(18)28)23(32)31-25-30-21(13-36-25)17-7-5-6-15(22(17)29)8-9-26(2,3)35-4/h5-7,10-13H,8-9H2,1-4H3,(H,33,34)(H,30,31,32)/b14-10+