N-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]thiophene-2-carboxamide Openeye Name: N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]thiophene-2-carboxamide CAS Name: N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]thiophene-2-carboxamide Traditional Name: N-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]thiophene-2-carboxamide Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CNC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C17H13N5O2S/c23-16-12-9-19-22(11-5-2-1-3-6-11)15(12)20-14(21-16)10-18-17(24)13-7-4-8-25-13/h1-9,19H,10H2,(H,18,24)