5-[2-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoranyl-pyridine-2-carbonitrile

Systemtic Name: 5-[2-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoranyl-pyridine-2-carbonitrile Openeye Name: 5-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoro-pyridine-2-carbonitrile CAS Name: 5-[2-[2-amino-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoro-2-pyridinecarbonitrile IUPAC Name: 5-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoropyridine-2-carbonitrile Traditional Name: 5-[2-[2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-fluoro-picolinonitrile Formula: C24H25FN8 MolecularWeight: 444.507303

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)C5=CC(=C(N=C5)C#N)F)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)C5=CC(=C(N=C5)C#N)F)N

InChI

InChI=1S/C24H25FN8/c1-31-6-8-32(9-7-31)22-12-23(30-24(27)29-22)33-5-4-16-2-3-17(10-19(16)15-33)18-11-20(25)21(13-26)28-14-18/h2-3,10-12,14H,4-9,15H2,1H3,(H2,27,29,30)