2-methyl-2-[8-[3-[(Z)-3-methylsulfonyl-2-(4-methylsulfonylphenyl)prop-1-enyl]phenyl]quinolin-6-yl]propanenitrile

Systemtic Name: 2-methyl-2-[8-[3-[(Z)-3-methylsulfonyl-2-(4-methylsulfonylphenyl)prop-1-enyl]phenyl]quinolin-6-yl]propanenitrile Openeye Name: 2-methyl-2-[8-[3-[(Z)-3-methylsulfonyl-2-(4-methylsulfonylphenyl)prop-1-enyl]phenyl]-6-quinolyl]propanenitrile CAS Name: 2-methyl-2-[8-[3-[(Z)-3-methylsulfonyl-2-(4-methylsulfonylphenyl)prop-1-enyl]phenyl]-6-quinolinyl]propanenitrile IUPAC Name: 2-methyl-2-[8-[3-[(Z)-3-methylsulfonyl-2-(4-methylsulfonylphenyl)prop-1-enyl]phenyl]quinolin-6-yl]propanenitrile Traditional Name: 2-[8-[3-[(Z)-3-mesyl-2-(4-mesylphenyl)prop-1-enyl]phenyl]-6-quinolyl]-2-methyl-propionitrile Formula: C30H28N2O4S2 MolecularWeight: 544.68432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H28N2O4S2/c1-30(2,20-31)26-17-24-9-6-14-32-29(24)28(18-26)23-8-5-7-21(15-23)16-25(19-37(3,33)34)22-10-12-27(13-11-22)38(4,35)36/h5-18H,19H2,1-4H3/b25-16+