N-[4-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-piperonylamide Formula: C19H13N5O4 MolecularWeight: 375.33762

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4C5=NC=NC(=O)C5=CN4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4C5=NC=NC(=O)C5=CN4

InChI

InChI=1S/C19H13N5O4/c25-18(11-1-6-15-16(7-11)28-10-27-15)23-12-2-4-13(5-3-12)24-17-14(8-22-24)19(26)21-9-20-17/h1-9,22H,10H2,(H,23,25)