2-(5-chloranylthiophen-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-[(3,4-dimethoxyphenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-veratryl-cinchoninamide Formula: C23H19ClN2O3S MolecularWeight: 438.92656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)OC

InChI

InChI=1S/C23H19ClN2O3S/c1-28-19-8-7-14(11-20(19)29-2)13-25-23(27)16-12-18(21-9-10-22(24)30-21)26-17-6-4-3-5-15(16)17/h3-12H,13H2,1-2H3,(H,25,27)