N-[3-cyano-5-methyl-4-(4-methylphenyl)thiophen-2-yl]-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[3-cyano-5-methyl-4-(4-methylphenyl)thiophen-2-yl]-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Openeye Name: N-[3-cyano-5-methyl-4-(p-tolyl)-2-thienyl]-2-(4-isobutylphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-5-methyl-4-(4-methylphenyl)-2-thiophenyl]-2-[4-(2-methylpropyl)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-methyl-4-(4-methylphenyl)thiophen-2-yl]-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Traditional Name: N-[3-cyano-5-methyl-4-(p-tolyl)-2-thienyl]-2-(4-isobutylphenyl)cinchoninamide Formula: C33H29N3OS MolecularWeight: 515.66786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)CC(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)CC(C)C)C

InChI

InChI=1S/C33H29N3OS/c1-20(2)17-23-11-15-24(16-12-23)30-18-27(26-7-5-6-8-29(26)35-30)32(37)36-33-28(19-34)31(22(4)38-33)25-13-9-21(3)10-14-25/h5-16,18,20H,17H2,1-4H3,(H,36,37)