6-bromanyl-N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thiophenyl]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]-2-p-phenetyl-cinchoninamide Formula: C31H24BrN3O3S MolecularWeight: 598.50956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)OC)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)OC)C#N

InChI

InChI=1S/C31H24BrN3O3S/c1-4-38-23-12-5-19(6-13-23)28-16-25(24-15-21(32)9-14-27(24)34-28)30(36)35-31-26(17-33)29(18(2)39-31)20-7-10-22(37-3)11-8-20/h5-16H,4H2,1-3H3,(H,35,36)