5-azanyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]isoquinolin-1-one

Systemtic Name: 5-azanyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]isoquinolin-1-one Openeye Name: 5-amino-2-[(5-methyl-1H-imidazol-4-yl)methyl]isoquinolin-1-one CAS Name: 5-amino-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1-isoquinolinone IUPAC Name: 5-amino-2-[(5-methyl-1H-imidazol-4-yl)methyl]isoquinolin-1-one Traditional Name: 5-amino-2-[(5-methyl-1H-imidazol-4-yl)methyl]isocarbostyril Formula: C14H14N4O MolecularWeight: 254.28716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2C=CC3=C(C2=O)C=CC=C3N

Isomeric SMILES

CC1=C(N=CN1)CN2C=CC3=C(C2=O)C=CC=C3N

InChI

InChI=1S/C14H14N4O/c1-9-13(17-8-16-9)7-18-6-5-10-11(14(18)19)3-2-4-12(10)15/h2-6,8H,7,15H2,1H3,(H,16,17)