(E)-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[3,5-dimethyl-4-(2-pyridylmethoxy)phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-[3,5-dimethyl-4-(2-pyridinylmethoxy)phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-[3,5-dimethyl-4-(2-pyridylmethoxy)phenyl]-2-tosyl-acrylonitrile Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C(=C2)C)OCC3=CC=CC=N3)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC(=C(C(=C2)C)OCC3=CC=CC=N3)C)/C#N

InChI

InChI=1S/C24H22N2O3S/c1-17-7-9-22(10-8-17)30(27,28)23(15-25)14-20-12-18(2)24(19(3)13-20)29-16-21-6-4-5-11-26-21/h4-14H,16H2,1-3H3/b23-14+