(Z)-2-(4-methylsulfonylphenyl)-3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]prop-2-enenitrile

Systemtic Name: (Z)-2-(4-methylsulfonylphenyl)-3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]prop-2-enenitrile Openeye Name: (Z)-3-[3-(6-isopropyl-8-quinolyl)phenyl]-2-(4-methylsulfonylphenyl)prop-2-enenitrile CAS Name: (Z)-2-(4-methylsulfonylphenyl)-3-[3-(6-propan-2-yl-8-quinolinyl)phenyl]-2-propenenitrile IUPAC Name: (Z)-2-(4-methylsulfonylphenyl)-3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]prop-2-enenitrile Traditional Name: (Z)-3-[3-(6-isopropyl-8-quinolyl)phenyl]-2-(4-mesylphenyl)acrylonitrile Formula: C28H24N2O2S MolecularWeight: 452.56736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C=C(C#N)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)/C=C(\C#N)/C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C28H24N2O2S/c1-19(2)24-16-23-8-5-13-30-28(23)27(17-24)22-7-4-6-20(14-22)15-25(18-29)21-9-11-26(12-10-21)33(3,31)32/h4-17,19H,1-3H3/b25-15+