(E)-3-[2,6-bis(chloranyl)-4-[[4-[2-fluoranyl-3-(3-propoxypropyl)phenyl]-1,3-thiazol-2-yl]carbonyl]phenyl]-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-[2,6-bis(chloranyl)-4-[[4-[2-fluoranyl-3-(3-propoxypropyl)phenyl]-1,3-thiazol-2-yl]carbonyl]phenyl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[2,6-dichloro-4-[4-[2-fluoro-3-(3-propoxypropyl)phenyl]thiazole-2-carbonyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-dichloro-4-[[4-[2-fluoro-3-(3-propoxypropyl)phenyl]-2-thiazolyl]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-dichloro-4-[4-[2-fluoro-3-(3-propoxypropyl)phenyl]-1,3-thiazole-2-carbonyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-dichloro-4-[4-[2-fluoro-3-(3-propoxypropyl)phenyl]thiazole-2-carbonyl]phenyl]-2-methyl-acrylic acid Formula: C26H24Cl2FNO4S MolecularWeight: 536.442463

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCCC1=CC=CC(=C1F)C2=CSC(=N2)C(=O)C3=CC(=C(C(=C3)Cl)C=C(C)C(=O)O)Cl

Isomeric SMILES

CCCOCCCC1=CC=CC(=C1F)C2=CSC(=N2)C(=O)C3=CC(=C(C(=C3)Cl)/C=C(\C)/C(=O)O)Cl

InChI

InChI=1S/C26H24Cl2FNO4S/c1-3-9-34-10-5-7-16-6-4-8-18(23(16)29)22-14-35-25(30-22)24(31)17-12-20(27)19(21(28)13-17)11-15(2)26(32)33/h4,6,8,11-14H,3,5,7,9-10H2,1-2H3,(H,32,33)/b15-11+