[5-bromanyl-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-8-yl] N,N-dimethylcarbamate

Systemtic Name: [5-bromanyl-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-8-yl] N,N-dimethylcarbamate Openeye Name: [5-bromo-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-8-yl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [5-bromo-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-8-yl] ester IUPAC Name: [5-bromo-2-(pyridin-4-ylamino)-3,4-dihydro-1H-isoquinolin-8-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [5-bromo-2-(4-pyridylamino)-3,4-dihydro-1H-isoquinolin-8-yl] ester Formula: C17H19BrN4O2 MolecularWeight: 391.26236

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C2CN(CCC2=C(C=C1)Br)NC3=CC=NC=C3

Isomeric SMILES

CN(C)C(=O)OC1=C2CN(CCC2=C(C=C1)Br)NC3=CC=NC=C3

InChI

InChI=1S/C17H19BrN4O2/c1-21(2)17(23)24-16-4-3-15(18)13-7-10-22(11-14(13)16)20-12-5-8-19-9-6-12/h3-6,8-9H,7,10-11H2,1-2H3,(H,19,20)