5-[1-[3,4-bis[bis(fluoranyl)methoxy]phenyl]-2-pyridin-4-yl-ethyl]-2-(3-methoxyphenyl)sulfanyl-pyridine

Systemtic Name: 5-[1-[3,4-bis[bis(fluoranyl)methoxy]phenyl]-2-pyridin-4-yl-ethyl]-2-(3-methoxyphenyl)sulfanyl-pyridine Openeye Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(4-pyridyl)ethyl]-2-(3-methoxyphenyl)sulfanyl-pyridine CAS Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-pyridin-4-ylethyl]-2-[(3-methoxyphenyl)thio]pyridine IUPAC Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-pyridin-4-ylethyl]-2-(3-methoxyphenyl)sulfanylpyridine Traditional Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(4-pyridyl)ethyl]-2-[(3-methoxyphenyl)thio]pyridine Formula: C27H22F4N2O3S MolecularWeight: 530.533793

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=NC=C(C=C2)C(CC3=CC=NC=C3)C4=CC(=C(C=C4)OC(F)F)OC(F)F

Isomeric SMILES

COC1=CC(=CC=C1)SC2=NC=C(C=C2)C(CC3=CC=NC=C3)C4=CC(=C(C=C4)OC(F)F)OC(F)F

InChI

InChI=1S/C27H22F4N2O3S/c1-34-20-3-2-4-21(15-20)37-25-8-6-19(16-33-25)22(13-17-9-11-32-12-10-17)18-5-7-23(35-26(28)29)24(14-18)36-27(30)31/h2-12,14-16,22,26-27H,13H2,1H3