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

Systemtic Name: N-[3-cyano-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thienyl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thiophenyl]-2-(3-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-4-(4-fluorophenyl)-5-methylthiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-4-(4-fluorophenyl)-5-methyl-2-thienyl]-2-m-phenetyl-cinchoninamide Formula: C30H22FN3O2S MolecularWeight: 507.577983

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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(=C(S4)C)C5=CC=C(C=C5)F)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)F)C#N

InChI

InChI=1S/C30H22FN3O2S/c1-3-36-22-8-6-7-20(15-22)27-16-24(23-9-4-5-10-26(23)33-27)29(35)34-30-25(17-32)28(18(2)37-30)19-11-13-21(31)14-12-19/h4-16H,3H2,1-2H3,(H,34,35)