2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: 2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[4-keto-1-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NCC=C

Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NCC=C

InChI

InChI=1S/C17H17N5O3S/c1-3-8-18-14(23)10-26-17-20-15-11(16(24)21-17)9-19-22(15)12-6-4-5-7-13(12)25-2/h3-7,9,19H,1,8,10H2,2H3,(H,18,23)