N-(4-methylpentan-2-yl)-2-thiomorpholin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-(4-methylpentan-2-yl)-2-thiomorpholin-4-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-dimethylbutyl)-2-thiomorpholino-quinoline-4-carboxamide CAS Name: N-(4-methylpentan-2-yl)-2-thiomorpholin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(4-methylpentan-2-yl)-2-thiomorpholin-4-ylquinoline-4-carboxamide Traditional Name: N-(1,3-dimethylbutyl)-2-thiomorpholino-cinchoninamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCSCC3

Isomeric SMILES

CC(C)CC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCSCC3

InChI

InChI=1S/C20H27N3OS/c1-14(2)12-15(3)21-20(24)17-13-19(23-8-10-25-11-9-23)22-18-7-5-4-6-16(17)18/h4-7,13-15H,8-12H2,1-3H3,(H,21,24)