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

Systemtic Name: 6-chloranyl-2-(5-methylthiophen-2-yl)-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Openeye Name: 6-chloro-2-(5-methyl-2-thienyl)-N-(4-pyridylmethyl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(5-methyl-2-thiophenyl)-N-(pyridin-4-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-2-(5-methylthiophen-2-yl)-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Traditional Name: 6-chloro-2-(5-methyl-2-thienyl)-N-(4-pyridylmethyl)cinchoninamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C21H16ClN3OS/c1-13-2-5-20(27-13)19-11-17(16-10-15(22)3-4-18(16)25-19)21(26)24-12-14-6-8-23-9-7-14/h2-11H,12H2,1H3,(H,24,26)