N-[5-[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxy-benzamide

Systemtic Name: N-[5-[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxy-benzamide Openeye Name: N-[5-[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxy-benzamide CAS Name: N-[5-[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxybenzamide IUPAC Name: N-[5-[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxybenzamide Traditional Name: N-[5-[2-(4-methylpiperazino)pyrimidin-4-yl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-phenoxy-benzamide Formula: C27H28N8O2 MolecularWeight: 496.56362

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=CC(=N2)N3CC4=C(C3)NN=C4NC(=O)C5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1)C2=NC=CC(=N2)N3CC4=C(C3)NN=C4NC(=O)C5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C27H28N8O2/c1-33-12-14-34(15-13-33)27-28-11-10-24(29-27)35-17-22-23(18-35)31-32-25(22)30-26(36)19-6-5-9-21(16-19)37-20-7-3-2-4-8-20/h2-11,16H,12-15,17-18H2,1H3,(H2,30,31,32,36)