N-methyl-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(oxan-2-ylmethyl)benzamide

Systemtic Name: N-methyl-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(oxan-2-ylmethyl)benzamide Openeye Name: N-methyl-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(tetrahydropyran-2-ylmethyl)benzamide CAS Name: N-methyl-3-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-N-(2-oxanylmethyl)benzamide IUPAC Name: N-methyl-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(oxan-2-ylmethyl)benzamide Traditional Name: N-methyl-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-(tetrahydropyran-2-ylmethyl)benzamide Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NC3=CC=CC(=C3)C(=O)N(C)CC4CCCCO4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NC3=CC=CC(=C3)C(=O)N(C)CC4CCCCO4

InChI

InChI=1S/C20H24N6O2/c1-25(12-16-8-3-4-9-28-16)20(27)14-6-5-7-15(10-14)24-18-17-11-23-26(2)19(17)22-13-21-18/h5-7,10-11,13,16H,3-4,8-9,12H2,1-2H3,(H,21,22,24)