7-chloranyl-8-methyl-2-pyridin-3-yl-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 7-chloranyl-8-methyl-2-pyridin-3-yl-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide Openeye Name: 7-chloro-8-methyl-2-(3-pyridyl)-N-(2-thienylmethyl)quinoline-4-carboxamide CAS Name: 7-chloro-8-methyl-2-(3-pyridinyl)-N-(thiophen-2-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-8-methyl-2-pyridin-3-yl-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide Traditional Name: 7-chloro-8-methyl-2-(3-pyridyl)-N-(2-thenyl)cinchoninamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC3=CC=CS3)C4=CN=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC3=CC=CS3)C4=CN=CC=C4)Cl

InChI

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