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

Systemtic Name: 4-[1-[2-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]piperidin-4-yl]benzamide Openeye Name: 4-[1-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-piperidyl]benzamide CAS Name: 4-[1-[2-[2-amino-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-piperidinyl]benzamide IUPAC Name: 4-[1-[2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]piperidin-4-yl]benzamide Traditional Name: 4-[1-[2-[2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-piperidyl]benzamide Formula: C30H38N8O MolecularWeight: 526.67572

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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)C6=CC=C(C=C6)C(=O)N)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)N5CCC(CC5)C6=CC=C(C=C6)C(=O)N)N

InChI

InChI=1S/C30H38N8O/c1-35-14-16-37(17-15-35)27-19-28(34-30(32)33-27)38-13-10-22-6-7-26(18-25(22)20-38)36-11-8-23(9-12-36)21-2-4-24(5-3-21)29(31)39/h2-7,18-19,23H,8-17,20H2,1H3,(H2,31,39)(H2,32,33,34)