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

Systemtic Name: 1-[2-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]piperidine-4-carbonitrile Openeye Name: 1-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]piperidine-4-carbonitrile CAS Name: 1-[2-[2-amino-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]piperidine-4-carbonitrile Traditional Name: 1-[2-[2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]isonipecotonitrile Formula: C24H32N8 MolecularWeight: 432.56448

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)N5CCC(CC5)C#N)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)N5CCC(CC5)C#N)N

InChI

InChI=1S/C24H32N8/c1-29-10-12-31(13-11-29)22-15-23(28-24(26)27-22)32-9-6-19-2-3-21(14-20(19)17-32)30-7-4-18(16-25)5-8-30/h2-3,14-15,18H,4-13,17H2,1H3,(H2,26,27,28)