N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-[3-[6-(methylamino)pyrimidin-4-yl]pyridin-2-yl]isoquinoline-1,5-diamine

Systemtic Name: N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-[3-[6-(methylamino)pyrimidin-4-yl]pyridin-2-yl]isoquinoline-1,5-diamine Openeye Name: N5-(5-tert-butyl-2-methyl-pyrazol-3-yl)-6-methyl-N5-[3-[6-(methylamino)pyrimidin-4-yl]-2-pyridyl]isoquinoline-1,5-diamine CAS Name: N5-(5-tert-butyl-2-methyl-3-pyrazolyl)-6-methyl-N5-[3-[6-(methylamino)-4-pyrimidinyl]-2-pyridinyl]isoquinoline-1,5-diamine IUPAC Name: 5-N-(5-tert-butyl-2-methylpyrazol-3-yl)-6-methyl-5-N-[3-[6-(methylamino)pyrimidin-4-yl]pyridin-2-yl]isoquinoline-1,5-diamine Traditional Name: (1-amino-6-methyl-5-isoquinolyl)-(5-tert-butyl-2-methyl-pyrazol-3-yl)-[3-[6-(methylamino)pyrimidin-4-yl]-2-pyridyl]amine Formula: C28H31N9 MolecularWeight: 493.60604

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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=CC(=NC=N5)NC

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=CC(=NC=N5)NC

InChI

InChI=1S/C28H31N9/c1-17-9-10-19-18(11-13-31-26(19)29)25(17)37(24-15-22(28(2,3)4)35-36(24)6)27-20(8-7-12-32-27)21-14-23(30-5)34-16-33-21/h7-16H,1-6H3,(H2,29,31)(H,30,33,34)