(E)-3-[2,6-bis(fluoranyl)-4-[[4-[3-(2-heptoxyethyl)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-prop-2-enoic acid

Systemtic Name: (E)-3-[2,6-bis(fluoranyl)-4-[[4-[3-(2-heptoxyethyl)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-prop-2-enoic acid Openeye Name: (E)-3-[2,6-difluoro-4-[[4-[3-(2-heptoxyethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-prop-2-enoic acid CAS Name: (E)-3-[2,6-difluoro-4-[[[4-[3-(2-heptoxyethyl)-2-methoxyphenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methoxy-2-propenoic acid IUPAC Name: (E)-3-[2,6-difluoro-4-[[4-[3-(2-heptoxyethyl)-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methoxyprop-2-enoic acid Traditional Name: (E)-3-[2,6-difluoro-4-[[4-[3-(2-heptoxyethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-acrylic acid Formula: C30H34F2N2O6S MolecularWeight: 588.662566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)C=C(C(=O)O)OC)F

Isomeric SMILES

CCCCCCCOCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)F)/C=C(\C(=O)O)/OC)F

InChI

InChI=1S/C30H34F2N2O6S/c1-4-5-6-7-8-13-40-14-12-19-10-9-11-21(27(19)39-3)25-18-41-30(33-25)34-28(35)20-15-23(31)22(24(32)16-20)17-26(38-2)29(36)37/h9-11,15-18H,4-8,12-14H2,1-3H3,(H,36,37)(H,33,34,35)/b26-17+