2-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-(3-methyl-1-phenyl-4-pyrazolyl)-2-pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-(3-methyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Formula: C23H21N5 MolecularWeight: 367.44634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC(=NC=C2)N3CCC4=CC=CC=C4C3)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C=C1C2=NC(=NC=C2)N3CCC4=CC=CC=C4C3)C5=CC=CC=C5

InChI

InChI=1S/C23H21N5/c1-17-21(16-28(26-17)20-9-3-2-4-10-20)22-11-13-24-23(25-22)27-14-12-18-7-5-6-8-19(18)15-27/h2-11,13,16H,12,14-15H2,1H3