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

Systemtic Name: 2-[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]acetyl]amino]thiophene-3-carboxamide Formula: C17H20N8O2S MolecularWeight: 400.4581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C17H20N8O2S/c1-23-15-12(8-21-23)16(20-10-19-15)25-5-3-24(4-6-25)9-13(26)22-17-11(14(18)27)2-7-28-17/h2,7-8,10H,3-6,9H2,1H3,(H2,18,27)(H,22,26)