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

Systemtic Name: N-[2-bromanyl-4-(pyridin-4-ylmethyl)phenyl]-3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzamide Openeye Name: N-[2-bromo-4-(4-pyridylmethyl)phenyl]-3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]benzamide CAS Name: N-[2-bromo-4-(pyridin-4-ylmethyl)phenyl]-3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]benzamide IUPAC Name: N-[2-bromo-4-(pyridin-4-ylmethyl)phenyl]-3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzamide Traditional Name: N-[2-bromo-4-(4-pyridylmethyl)phenyl]-3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]benzamide Formula: C32H28BrN3O3S MolecularWeight: 614.55202

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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=C(C=C(C=C4)CC5=CC=NC=C5)Br)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(=O)NC4=C(C=C(C=C4)CC5=CC=NC=C5)Br)S(=O)(=O)C

InChI

InChI=1S/C32H28BrN3O3S/c1-32(2,40(3,38)39)26-19-24-8-5-13-35-30(24)27(20-26)23-6-4-7-25(18-23)31(37)36-29-10-9-22(17-28(29)33)16-21-11-14-34-15-12-21/h4-15,17-20H,16H2,1-3H3,(H,36,37)