2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-[2,3,5,6-tetrakis(chloranyl)phenyl]ethanamide

Systemtic Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-[2,3,5,6-tetrakis(chloranyl)phenyl]ethanamide Openeye Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-(2,3,5,6-tetrachlorophenyl)acetamide CAS Name: 2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-N-(2,3,5,6-tetrachlorophenyl)acetamide IUPAC Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-(2,3,5,6-tetrachlorophenyl)acetamide Traditional Name: 2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-N-(2,3,5,6-tetrachlorophenyl)acetamide Formula: C18H17Cl4N7O MolecularWeight: 489.18588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=C(C(=CC(=C4Cl)Cl)Cl)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC(=O)NC4=C(C(=CC(=C4Cl)Cl)Cl)Cl

InChI

InChI=1S/C18H17Cl4N7O/c1-27-17-10(7-25-27)18(24-9-23-17)29-4-2-28(3-5-29)8-13(30)26-16-14(21)11(19)6-12(20)15(16)22/h6-7,9H,2-5,8H2,1H3,(H,26,30)