(7-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanone

Systemtic Name: (7-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Openeye Name: (7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanone CAS Name: (7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]methanone IUPAC Name: (7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Traditional Name: (7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanone Formula: C21H20BrN3O MolecularWeight: 410.307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2C(=O)N3CCC4=C(C3)C=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2C(=O)N3CCC4=C(C3)C=C(C=C4)Br)C

InChI

InChI=1S/C21H20BrN3O/c1-14-11-15(2)25(23-14)20-6-4-3-5-19(20)21(26)24-10-9-16-7-8-18(22)12-17(16)13-24/h3-8,11-12H,9-10,13H2,1-2H3