4-(4-methylquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-methylquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide Openeye Name: 4-(4-methyl-2-quinolyl)-N-(3-morpholinopropyl)piperazine-1-carbothioamide CAS Name: 4-(4-methyl-2-quinolinyl)-N-[3-(4-morpholinyl)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-methylquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(4-methyl-2-quinolyl)-N-(3-morpholinopropyl)piperazine-1-carbothioamide Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3CCN(CC3)C(=S)NCCCN4CCOCC4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3CCN(CC3)C(=S)NCCCN4CCOCC4

InChI

InChI=1S/C22H31N5OS/c1-18-17-21(24-20-6-3-2-5-19(18)20)26-9-11-27(12-10-26)22(29)23-7-4-8-25-13-15-28-16-14-25/h2-3,5-6,17H,4,7-16H2,1H3,(H,23,29)