3,3-bis[[3-(4-fluoranylphenoxy)phenyl]methylsulfanyl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: 3,3-bis[[3-(4-fluoranylphenoxy)phenyl]methylsulfanyl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: 3,3-bis[[3-(4-fluorophenoxy)phenyl]methylsulfanyl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: 3,3-bis[[3-(4-fluorophenoxy)phenyl]methylthio]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: 3,3-bis[[3-(4-fluorophenoxy)phenyl]methylsulfanyl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: 3,3-bis[[3-(4-fluorophenoxy)benzyl]thio]-2-(2-pyridyl)acrylonitrile Formula: C34H24F2N2O2S2 MolecularWeight: 594.693366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=C(SCC2=CC(=CC=C2)OC3=CC=C(C=C3)F)SCC4=CC(=CC=C4)OC5=CC=C(C=C5)F)C#N

Isomeric SMILES

C1=CC=NC(=C1)C(=C(SCC2=CC(=CC=C2)OC3=CC=C(C=C3)F)SCC4=CC(=CC=C4)OC5=CC=C(C=C5)F)C#N

InChI

InChI=1S/C34H24F2N2O2S2/c35-26-10-14-28(15-11-26)39-30-7-3-5-24(19-30)22-41-34(32(21-37)33-9-1-2-18-38-33)42-23-25-6-4-8-31(20-25)40-29-16-12-27(36)13-17-29/h1-20H,22-23H2