N-(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)-2-(4-ethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)-2-(4-ethylphenyl)quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)-2-(4-ethylphenyl)quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-4-ethyl-5-methyl-2-thiophenyl)-2-(4-ethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-2-(4-ethylphenyl)quinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)-2-(4-ethylphenyl)cinchoninamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)CC)C(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)CC)C(=O)N

InChI

InChI=1S/C26H25N3O2S/c1-4-16-10-12-17(13-11-16)22-14-20(19-8-6-7-9-21(19)28-22)25(31)29-26-23(24(27)30)18(5-2)15(3)32-26/h6-14H,4-5H2,1-3H3,(H2,27,30)(H,29,31)