N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-methyl-propionamide Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(C)CC3COC4=CC=CC=C4O3

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(C)CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H21N5O4/c1-22(10-13-11-27-15-5-3-4-6-16(15)28-13)17(25)7-8-24-12-20-18-14(19(24)26)9-21-23(18)2/h3-6,9,12-13H,7-8,10-11H2,1-2H3