6-chloranyl-2-pyridin-3-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-2-pyridin-3-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Openeye Name: 6-chloro-2-(3-pyridyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(3-pyridinyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-2-pyridin-3-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Traditional Name: 6-chloro-2-(3-pyridyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cinchoninamide Formula: C22H17ClN4OS MolecularWeight: 420.91458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

InChI

InChI=1S/C22H17ClN4OS/c23-14-7-8-17-15(10-14)16(11-19(25-17)13-4-3-9-24-12-13)21(28)27-22-26-18-5-1-2-6-20(18)29-22/h3-4,7-12H,1-2,5-6H2,(H,26,27,28)