N-[7-chloranyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-oxidanylidene-isoquinolin-5-yl]-N-methyl-ethanamide

Systemtic Name: N-[7-chloranyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-oxidanylidene-isoquinolin-5-yl]-N-methyl-ethanamide Openeye Name: N-[7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-oxo-5-isoquinolyl]-N-methyl-acetamide CAS Name: N-[7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-oxo-5-isoquinolinyl]-N-methylacetamide IUPAC Name: N-[7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-oxoisoquinolin-5-yl]-N-methylacetamide Traditional Name: N-[7-chloro-1-keto-2-[(5-methyl-1H-imidazol-4-yl)methyl]-5-isoquinolyl]-N-methyl-acetamide Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2C=CC3=C(C=C(C=C3C2=O)Cl)N(C)C(=O)C

Isomeric SMILES

CC1=C(N=CN1)CN2C=CC3=C(C=C(C=C3C2=O)Cl)N(C)C(=O)C

InChI

InChI=1S/C17H17ClN4O2/c1-10-15(20-9-19-10)8-22-5-4-13-14(17(22)24)6-12(18)7-16(13)21(3)11(2)23/h4-7,9H,8H2,1-3H3,(H,19,20)