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

Systemtic Name: 6-bromanyl-N-[3-cyano-4-(2,5-dimethylphenyl)thiophen-2-yl]-2-(3-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-cyano-4-(2,5-dimethylphenyl)-2-thienyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-cyano-4-(2,5-dimethylphenyl)-2-thiophenyl]-2-(3-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-cyano-4-(2,5-dimethylphenyl)thiophen-2-yl]-2-(3-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-cyano-4-(2,5-dimethylphenyl)-2-thienyl]-2-(3-methoxyphenyl)cinchoninamide Formula: C30H22BrN3O2S MolecularWeight: 568.48358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC(=CC=C5)OC

InChI

InChI=1S/C30H22BrN3O2S/c1-17-7-8-18(2)22(11-17)26-16-37-30(25(26)15-32)34-29(35)24-14-28(19-5-4-6-21(12-19)36-3)33-27-10-9-20(31)13-23(24)27/h4-14,16H,1-3H3,(H,34,35)