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

Systemtic Name: N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-thiophen-2-yl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thienyl]-2-(5-methyl-2-furyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thiophenyl]-2-(5-methyl-2-furanyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-4-(2,4-dichlorophenyl)-5-methylthiophen-2-yl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thienyl]-2-(5-methyl-2-furyl)cinchoninamide Formula: C27H17Cl2N3O2S MolecularWeight: 518.41378

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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=C(C=C(C=C5)Cl)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C27H17Cl2N3O2S/c1-14-7-10-24(34-14)23-12-19(17-5-3-4-6-22(17)31-23)26(33)32-27-20(13-30)25(15(2)35-27)18-9-8-16(28)11-21(18)29/h3-12H,1-2H3,(H,32,33)