N-[6-(4-methylsulfanylphenyl)pyridin-3-yl]-3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzamide

Systemtic Name: N-[6-(4-methylsulfanylphenyl)pyridin-3-yl]-3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzamide Openeye Name: 3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]-N-[6-(4-methylsulfanylphenyl)-3-pyridyl]benzamide CAS Name: 3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]-N-[6-[4-(methylthio)phenyl]-3-pyridinyl]benzamide IUPAC Name: N-[6-(4-methylsulfanylphenyl)pyridin-3-yl]-3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzamide Traditional Name: 3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]-N-[6-[4-(methylthio)phenyl]-3-pyridyl]benzamide Formula: C32H29N3O3S2 MolecularWeight: 567.72096

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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=CN=C(C=C4)C5=CC=C(C=C5)SC)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(=O)NC4=CN=C(C=C4)C5=CC=C(C=C5)SC)S(=O)(=O)C

InChI

InChI=1S/C32H29N3O3S2/c1-32(2,40(4,37)38)25-18-23-9-6-16-33-30(23)28(19-25)22-7-5-8-24(17-22)31(36)35-26-12-15-29(34-20-26)21-10-13-27(39-3)14-11-21/h5-20H,1-4H3,(H,35,36)