N-[4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-chloranyl-phenyl]ethanamide

Systemtic Name: N-[4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-chloranyl-phenyl]ethanamide Openeye Name: N-[4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-chloro-phenyl]acetamide CAS Name: N-[4-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-2-chlorophenyl]acetamide IUPAC Name: N-[4-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2-chlorophenyl]acetamide Traditional Name: N-[4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-chloro-phenyl]acetamide Formula: C16H17ClN6O MolecularWeight: 344.79878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C3=CC(=C(C=C3)NC(=O)C)Cl)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C3=CC(=C(C=C3)NC(=O)C)Cl)C(=NC=N2)N

InChI

InChI=1S/C16H17ClN6O/c1-8(2)23-16-13(15(18)19-7-20-16)14(22-23)10-4-5-12(11(17)6-10)21-9(3)24/h4-8H,1-3H3,(H,21,24)(H2,18,19,20)