N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[4-[(7-chloro-4-quinolinyl)amino]cyclohexyl]-2-[(4-methyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-2-(4-methylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-2-[(4-methylpyrimidin-2-yl)thio]acetamide Formula: C22H24ClN5OS MolecularWeight: 441.97686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)NC2CCC(CC2)NC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)NC2CCC(CC2)NC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C22H24ClN5OS/c1-14-8-10-25-22(26-14)30-13-21(29)28-17-5-3-16(4-6-17)27-19-9-11-24-20-12-15(23)2-7-18(19)20/h2,7-12,16-17H,3-6,13H2,1H3,(H,24,27)(H,28,29)