N-(4-azanylidene-2-phenethyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzamide

Systemtic Name: N-(4-azanylidene-2-phenethyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzamide Openeye Name: N-(4-imino-2-phenethyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzamide CAS Name: N-(4-imino-2-phenethyl-5-pyrazolo[3,4-d]pyrimidinyl)benzamide IUPAC Name: N-(4-imino-2-phenethylpyrazolo[3,4-d]pyrimidin-5-yl)benzamide Traditional Name: N-(4-imino-2-phenethyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzamide Formula: C20H18N6O MolecularWeight: 358.39652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=C3C(=N)N(C=NC3=N2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=C3C(=N)N(C=NC3=N2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H18N6O/c21-18-17-13-25(12-11-15-7-3-1-4-8-15)23-19(17)22-14-26(18)24-20(27)16-9-5-2-6-10-16/h1-10,13-14,21H,11-12H2,(H,24,27)