2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-1-one

Systemtic Name: 2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-1-one Openeye Name: 2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-1-one CAS Name: 2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1-butanone IUPAC Name: 2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-1-one Traditional Name: 2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-1-one Formula: C19H26N4O MolecularWeight: 326.43594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CCN1)NCC3=NC=CN3

Isomeric SMILES

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CCN1)NCC3=NC=CN3

InChI

InChI=1S/C19H26N4O/c1-19(2,3)18(23-12-15-20-10-11-21-15)17(24)16-14-7-5-4-6-13(14)8-9-22-16/h4-7,10-11,16,18,22-23H,8-9,12H2,1-3H3,(H,20,21)