N-[3-ethanoyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-phenyl]butanamide

Systemtic Name: N-[3-ethanoyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-phenyl]butanamide Openeye Name: N-[3-acetyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-phenyl]butanamide CAS Name: N-[3-acetyl-4-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]phenyl]butanamide IUPAC Name: N-[3-acetyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxyphenyl]butanamide Traditional Name: N-[3-acetyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-phenyl]butyramide Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OC2=NC=NC3=C2C=NN3C)C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OC2=NC=NC3=C2C=NN3C)C(=O)C

InChI

InChI=1S/C18H19N5O3/c1-4-5-16(25)22-12-6-7-15(13(8-12)11(2)24)26-18-14-9-21-23(3)17(14)19-10-20-18/h6-10H,4-5H2,1-3H3,(H,22,25)