4-methylsulfonyl-N-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]benzamide

Systemtic Name: 4-methylsulfonyl-N-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]benzamide Openeye Name: N-[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]-4-methylsulfonyl-benzamide CAS Name: 4-methylsulfonyl-N-[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]benzamide IUPAC Name: 4-methylsulfonyl-N-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]benzamide Traditional Name: 4-mesyl-N-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]benzamide Formula: C27H26N2O5S2 MolecularWeight: 522.63574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O5S2/c1-27(2,36(4,33)34)21-15-20-8-6-14-28-25(20)24(17-21)19-7-5-9-22(16-19)29-26(30)18-10-12-23(13-11-18)35(3,31)32/h5-17H,1-4H3,(H,29,30)