6-(4-azanylcyclohexyl)sulfanyl-7-chloranyl-2H-isoquinolin-1-one

Systemtic Name: 6-(4-azanylcyclohexyl)sulfanyl-7-chloranyl-2H-isoquinolin-1-one Openeye Name: 6-(4-aminocyclohexyl)sulfanyl-7-chloro-2H-isoquinolin-1-one CAS Name: 6-[(4-aminocyclohexyl)thio]-7-chloro-2H-isoquinolin-1-one IUPAC Name: 6-(4-aminocyclohexyl)sulfanyl-7-chloro-2H-isoquinolin-1-one Traditional Name: 6-[(4-aminocyclohexyl)thio]-7-chloro-isocarbostyril Formula: C15H17ClN2OS MolecularWeight: 308.82628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)SC2=C(C=C3C(=C2)C=CNC3=O)Cl

Isomeric SMILES

C1CC(CCC1N)SC2=C(C=C3C(=C2)C=CNC3=O)Cl

InChI

InChI=1S/C15H17ClN2OS/c16-13-8-12-9(5-6-18-15(12)19)7-14(13)20-11-3-1-10(17)2-4-11/h5-8,10-11H,1-4,17H2,(H,18,19)