(E)-3-[4-[[4-[3-(2-ethylbutoxymethyl)-2-methoxy-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-(2-ethylbutoxymethyl)-2-methoxy-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-(2-ethylbutoxymethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[4-[[[4-[3-(2-ethylbutoxymethyl)-2-methoxyphenyl]-2-thiazolyl]amino]-oxomethyl]-2,6-difluorophenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[4-[[4-[3-(2-ethylbutoxymethyl)-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-difluorophenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[4-[[4-[3-(2-ethylbutoxymethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-acrylic acid Formula: C28H30F2N2O5S MolecularWeight: 544.610006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)COCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)C=C(C)C(=O)O)F

Isomeric SMILES

CCC(CC)COCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)/C=C(\C)/C(=O)O)F

InChI

InChI=1S/C28H30F2N2O5S/c1-5-17(6-2)13-37-14-18-8-7-9-20(25(18)36-4)24-15-38-28(31-24)32-26(33)19-11-22(29)21(23(30)12-19)10-16(3)27(34)35/h7-12,15,17H,5-6,13-14H2,1-4H3,(H,34,35)(H,31,32,33)/b16-10+