(E)-3-[2,6-bis(fluoranyl)-4-[[4-[2-methoxy-3-[3-(3-methylbutoxy)propyl]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-methoxy-3-[3-(3-methylbutoxy)propyl]phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[2,6-difluoro-4-[[4-[3-(3-isopentyloxypropyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-difluoro-4-[[[4-[2-methoxy-3-[3-(3-methylbutoxy)propyl]phenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-difluoro-4-[[4-[2-methoxy-3-[3-(3-methylbutoxy)propyl]phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-difluoro-4-[[4-[3-(3-isoamoxypropyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C29H32F2N2O5S MolecularWeight: 558.636586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOCCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)C=C(C)C(=O)O)F

Isomeric SMILES

CC(C)CCOCCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)/C=C(\C)/C(=O)O)F

InChI

InChI=1S/C29H32F2N2O5S/c1-17(2)10-12-38-11-6-8-19-7-5-9-21(26(19)37-4)25-16-39-29(32-25)33-27(34)20-14-23(30)22(24(31)15-20)13-18(3)28(35)36/h5,7,9,13-17H,6,8,10-12H2,1-4H3,(H,35,36)(H,32,33,34)/b18-13+