2-[1-(4-methylphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[1-(4-methylphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-oxo-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-5-yl]acetamide CAS Name: 2-[1-(4-methylphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-N-prop-2-enylacetamide IUPAC Name: 2-[1-(4-methylphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-keto-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-5-yl]acetamide Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NCC=C

InChI

InChI=1S/C17H17N5O2/c1-3-8-18-15(23)10-21-11-19-16-14(17(21)24)9-20-22(16)13-6-4-12(2)5-7-13/h3-7,9,11H,1,8,10H2,2H3,(H,18,23)