N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)CCN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)CCN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C20H22N6O3/c1-20(2,3)19-24-14-9-12(5-6-15(14)29-19)23-16(27)7-8-26-11-21-17-13(18(26)28)10-22-25(17)4/h5-6,9-11H,7-8H2,1-4H3,(H,23,27)