(E)-3-[4-[[4-[3-[cyclohexyl(pentoxy)methyl]-2-fluoranyl-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-[cyclohexyl(pentoxy)methyl]-2-fluoranyl-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-[cyclohexyl(pentoxy)methyl]-2-fluoro-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[4-[[[4-[3-[cyclohexyl(pentoxy)methyl]-2-fluorophenyl]-2-thiazolyl]amino]-oxomethyl]-2,6-difluorophenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[4-[[4-[3-[cyclohexyl(pentoxy)methyl]-2-fluorophenyl]-1,3-thiazol-2-yl]carbamoyl]-2,6-difluorophenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[4-[[4-[3-[amoxy(cyclohexyl)methyl]-2-fluoro-phenyl]thiazol-2-yl]carbamoyl]-2,6-difluoro-phenyl]-2-methyl-acrylic acid Formula: C32H35F3N2O4S MolecularWeight: 600.69151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(C1CCCCC1)C2=CC=CC(=C2F)C3=CSC(=N3)NC(=O)C4=CC(=C(C(=C4)F)C=C(C)C(=O)O)F

Isomeric SMILES

CCCCCOC(C1CCCCC1)C2=CC=CC(=C2F)C3=CSC(=N3)NC(=O)C4=CC(=C(C(=C4)F)/C=C(\C)/C(=O)O)F

InChI

InChI=1S/C32H35F3N2O4S/c1-3-4-8-14-41-29(20-10-6-5-7-11-20)23-13-9-12-22(28(23)35)27-18-42-32(36-27)37-30(38)21-16-25(33)24(26(34)17-21)15-19(2)31(39)40/h9,12-13,15-18,20,29H,3-8,10-11,14H2,1-2H3,(H,39,40)(H,36,37,38)/b19-15+