(E)-3-[2,6-bis(fluoranyl)-4-[[4-[2-fluoranyl-3-(1-methoxyheptyl)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-(1-methoxyheptyl)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-(1-methoxyheptyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-difluoro-4-[[[4-[2-fluoro-3-(1-methoxyheptyl)phenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-difluoro-4-[[4-[2-fluoro-3-(1-methoxyheptyl)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-(1-methoxyheptyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C28H29F3N2O4S MolecularWeight: 546.60107

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC(=C1F)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)C=C(C)C(=O)O)F)OC

Isomeric SMILES

CCCCCCC(C1=CC=CC(=C1F)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)/C=C(\C)/C(=O)O)F)OC

InChI

InChI=1S/C28H29F3N2O4S/c1-4-5-6-7-11-24(37-3)19-10-8-9-18(25(19)31)23-15-38-28(32-23)33-26(34)17-13-21(29)20(22(30)14-17)12-16(2)27(35)36/h8-10,12-15,24H,4-7,11H2,1-3H3,(H,35,36)(H,32,33,34)/b16-12+