N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-(3-pyrimidin-4-ylpyridin-2-yl)isoquinoline-1,5-diamine

Systemtic Name: N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-(3-pyrimidin-4-ylpyridin-2-yl)isoquinoline-1,5-diamine Openeye Name: N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-(3-pyrimidin-4-yl-2-pyridyl)isoquinoline-1,5-diamine CAS Name: N5-(5-tert-butyl-2-methyl-3-pyrazolyl)-6-methyl-N5-[3-(4-pyrimidinyl)-2-pyridinyl]isoquinoline-1,5-diamine IUPAC Name: 5-N-(5-tert-butyl-2-methylpyrazol-3-yl)-6-methyl-5-N-(3-pyrimidin-4-ylpyridin-2-yl)isoquinoline-1,5-diamine Traditional Name: (1-amino-6-methyl-5-isoquinolyl)-(5-tert-butyl-2-methyl-pyrazol-3-yl)-[3-(4-pyrimidyl)-2-pyridyl]amine Formula: C27H28N8 MolecularWeight: 464.56482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=NC=C2)N)N(C3=CC(=NN3C)C(C)(C)C)C4=C(C=CC=N4)C5=NC=NC=C5

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=NC=C2)N)N(C3=CC(=NN3C)C(C)(C)C)C4=C(C=CC=N4)C5=NC=NC=C5

InChI

InChI=1S/C27H28N8/c1-17-8-9-19-18(10-14-30-25(19)28)24(17)35(23-15-22(27(2,3)4)33-34(23)5)26-20(7-6-12-31-26)21-11-13-29-16-32-21/h6-16H,1-5H3,(H2,28,30)