N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-(2,4-dimethoxyphenyl)cinchoninamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)OC)OC)C

InChI

InChI=1S/C25H21N3O3S/c1-14-15(2)32-25(20(14)13-26)28-24(29)19-12-22(27-21-8-6-5-7-17(19)21)18-10-9-16(30-3)11-23(18)31-4/h5-12H,1-4H3,(H,28,29)