N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-4,5-dimethyl-2-thienyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-4,5-dimethyl-2-thiophenyl)-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-4,5-dimethyl-2-thienyl)-2-p-phenetyl-cinchoninamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O3S/c1-4-31-17-11-9-16(10-12-17)21-13-19(18-7-5-6-8-20(18)27-21)24(30)28-25-22(23(26)29)14(2)15(3)32-25/h5-13H,4H2,1-3H3,(H2,26,29)(H,28,30)