4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]acetyl]amino]benzamide Formula: C19H22N8O2 MolecularWeight: 394.43038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C19H22N8O2/c1-25-18-15(10-23-25)19(22-12-21-18)27-8-6-26(7-9-27)11-16(28)24-14-4-2-13(3-5-14)17(20)29/h2-5,10,12H,6-9,11H2,1H3,(H2,20,29)(H,24,28)