6-chloranyl-2-(5-ethylthiophen-2-yl)-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-2-(5-ethylthiophen-2-yl)-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Openeye Name: 6-chloro-2-(5-ethyl-2-thienyl)-N-(4-pyridylmethyl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(5-ethyl-2-thiophenyl)-N-(pyridin-4-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-2-(5-ethylthiophen-2-yl)-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Traditional Name: 6-chloro-2-(5-ethyl-2-thienyl)-N-(4-pyridylmethyl)cinchoninamide Formula: C22H18ClN3OS MolecularWeight: 407.91582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C22H18ClN3OS/c1-2-16-4-6-21(28-16)20-12-18(17-11-15(23)3-5-19(17)26-20)22(27)25-13-14-7-9-24-10-8-14/h3-12H,2,13H2,1H3,(H,25,27)