3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(5-pyrimidin-2-yl-1H-pyrazol-4-yl)propan-1-one

Systemtic Name: 3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(5-pyrimidin-2-yl-1H-pyrazol-4-yl)propan-1-one Openeye Name: 3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(5-pyrimidin-2-yl-1H-pyrazol-4-yl)propan-1-one CAS Name: 3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-[5-(2-pyrimidinyl)-1H-pyrazol-4-yl]-1-propanone IUPAC Name: 3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(5-pyrimidin-2-yl-1H-pyrazol-4-yl)propan-1-one Traditional Name: 3-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-[5-(2-pyrimidyl)-1H-pyrazol-4-yl]propan-1-one Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CCN(C2)CCC(=O)C3=C(NN=C3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=CC2=C1CCN(C2)CCC(=O)C3=C(NN=C3)C4=NC=CC=N4

InChI

InChI=1S/C20H21N5O/c1-14-4-2-5-15-13-25(10-6-16(14)15)11-7-18(26)17-12-23-24-19(17)20-21-8-3-9-22-20/h2-5,8-9,12H,6-7,10-11,13H2,1H3,(H,23,24)