(E)-3-[2,6-bis(fluoranyl)-4-[[4-[2-fluoranyl-3-(1-methoxyhexyl)phenyl]-5-morpholin-4-yl-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-(1-methoxyhexyl)phenyl]-5-morpholin-4-yl-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-(1-methoxyhexyl)phenyl]-5-morpholino-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-difluoro-4-[[[4-[2-fluoro-3-(1-methoxyhexyl)phenyl]-5-(4-morpholinyl)-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(1-methoxyhexyl)phenyl]-5-morpholin-4-yl-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(1-methoxyhexyl)phenyl]-5-morpholino-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C31H34F3N3O5S MolecularWeight: 617.67897

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC(=C1F)C2=C(SC(=N2)NC(=O)C3=CC(=C(C(=C3)F)C=C(C)C(=O)O)F)N4CCOCC4)OC

Isomeric SMILES

CCCCCC(C1=CC=CC(=C1F)C2=C(SC(=N2)NC(=O)C3=CC(=C(C(=C3)F)/C=C(\C)/C(=O)O)F)N4CCOCC4)OC

InChI

InChI=1S/C31H34F3N3O5S/c1-4-5-6-10-25(41-3)20-8-7-9-21(26(20)34)27-29(37-11-13-42-14-12-37)43-31(35-27)36-28(38)19-16-23(32)22(24(33)17-19)15-18(2)30(39)40/h7-9,15-17,25H,4-6,10-14H2,1-3H3,(H,39,40)(H,35,36,38)/b18-15+