2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(1-propylbenzimidazol-2-yl)ethanamide

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(1-propylbenzimidazol-2-yl)ethanamide Openeye Name: 2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(1-propylbenzimidazol-2-yl)acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(1-propyl-2-benzimidazolyl)acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(1-propylbenzimidazol-2-yl)acetamide Traditional Name: 2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(1-propylbenzimidazol-2-yl)acetamide Formula: C18H19N7O2 MolecularWeight: 365.38916

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)CN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)CN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C18H19N7O2/c1-3-8-25-14-7-5-4-6-13(14)21-18(25)22-15(26)10-24-11-19-16-12(17(24)27)9-20-23(16)2/h4-7,9,11H,3,8,10H2,1-2H3,(H,21,22,26)