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

Systemtic Name: 3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]-N-quinolin-3-yl-benzamide Openeye Name: 3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]-N-(3-quinolyl)benzamide CAS Name: 3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]-N-(3-quinolinyl)benzamide IUPAC Name: 3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]-N-quinolin-3-ylbenzamide Traditional Name: 3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]-N-(3-quinolyl)benzamide Formula: C29H25N3O3S MolecularWeight: 495.5921

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(=O)NC4=CC5=CC=CC=C5N=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(=O)NC4=CC5=CC=CC=C5N=C4)S(=O)(=O)C

InChI

InChI=1S/C29H25N3O3S/c1-29(2,36(3,34)35)23-15-21-11-7-13-30-27(21)25(17-23)19-9-6-10-22(14-19)28(33)32-24-16-20-8-4-5-12-26(20)31-18-24/h4-18H,1-3H3,(H,32,33)