N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-cyclopropyl-N-(2,5-dimethoxybenzyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CC3=C(C=CC(=C3)OC)OC)C4CC4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CC3=C(C=CC(=C3)OC)OC)C4CC4

InChI

InChI=1S/C21H25N5O4/c1-24-20-17(11-23-24)21(28)25(13-22-20)9-8-19(27)26(15-4-5-15)12-14-10-16(29-2)6-7-18(14)30-3/h6-7,10-11,13,15H,4-5,8-9,12H2,1-3H3