4-(3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(oxan-4-ylamino)benzamide

Systemtic Name: 4-(3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(oxan-4-ylamino)benzamide Openeye Name: 4-(3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(tetrahydropyran-4-ylamino)benzamide CAS Name: 4-(3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(4-oxanylamino)benzamide IUPAC Name: 4-(3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(oxan-4-ylamino)benzamide Traditional Name: 4-(4-keto-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-(tetrahydropyran-4-ylamino)benzamide Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC=NC2=O)N(N1)C3=CC(=C(C=C3)C(=O)N)NC4CCOCC4

Isomeric SMILES

CC1=C2C(=NC=NC2=O)N(N1)C3=CC(=C(C=C3)C(=O)N)NC4CCOCC4

InChI

InChI=1S/C18H20N6O3/c1-10-15-17(20-9-21-18(15)26)24(23-10)12-2-3-13(16(19)25)14(8-12)22-11-4-6-27-7-5-11/h2-3,8-9,11,22-23H,4-7H2,1H3,(H2,19,25)