2-[[4-[(3-bromophenyl)amino]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol

Systemtic Name: 2-[[4-[(3-bromophenyl)amino]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Openeye Name: 2-[[4-(3-bromoanilino)-1-isopropyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol CAS Name: 2-[[4-(3-bromoanilino)-1-propan-2-yl-6-pyrazolo[3,4-d]pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-(3-bromoanilino)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Traditional Name: 2-[[4-(3-bromoanilino)-1-isopropyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Formula: C16H19BrN6O MolecularWeight: 391.26566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=NC(=N2)NCCO)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=NC(=N2)NCCO)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H19BrN6O/c1-10(2)23-15-13(9-19-23)14(21-16(22-15)18-6-7-24)20-12-5-3-4-11(17)8-12/h3-5,8-10,24H,6-7H2,1-2H3,(H2,18,20,21,22)