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

Systemtic Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2-(5-methyl-2-furyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]-2-(5-methyl-2-furanyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2-(5-methyl-2-furyl)cinchoninamide Formula: C31H27N3O2S MolecularWeight: 505.62998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)CC(C)C)C#N

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)CC(C)C)C#N

InChI

InChI=1S/C31H27N3O2S/c1-18(2)15-21-10-12-22(13-11-21)29-20(4)37-31(25(29)17-32)34-30(35)24-16-27(28-14-9-19(3)36-28)33-26-8-6-5-7-23(24)26/h5-14,16,18H,15H2,1-4H3,(H,34,35)