N-[3-cyano-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-cyano-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(4-isopropylphenyl)-2-thienyl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-4-(4-propan-2-ylphenyl)-2-thiophenyl]-2-(3-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-4-p-cumenyl-2-thienyl)-2-m-phenetyl-cinchoninamide Formula: C32H27N3O2S MolecularWeight: 517.64068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)C(C)C)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)C(C)C)C#N

InChI

InChI=1S/C32H27N3O2S/c1-4-37-24-9-7-8-23(16-24)30-17-26(25-10-5-6-11-29(25)34-30)31(36)35-32-27(18-33)28(19-38-32)22-14-12-21(13-15-22)20(2)3/h5-17,19-20H,4H2,1-3H3,(H,35,36)