1-[4-[5-(2-azanylpyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]piperidin-3-ol

Systemtic Name: 1-[4-[5-(2-azanylpyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]piperidin-3-ol Openeye Name: 1-[4-[5-(2-aminopyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]piperidin-3-ol CAS Name: 1-[4-[5-(2-amino-4-pyrimidinyl)-2,1-benzoxazol-3-yl]phenyl]-3-piperidinol IUPAC Name: 1-[4-[5-(2-aminopyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]piperidin-3-ol Traditional Name: 1-[4-[5-(2-aminopyrimidin-4-yl)anthranil-3-yl]phenyl]piperidin-3-ol Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N)O

Isomeric SMILES

C1CC(CN(C1)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N)O

InChI

InChI=1S/C22H21N5O2/c23-22-24-10-9-19(25-22)15-5-8-20-18(12-15)21(29-26-20)14-3-6-16(7-4-14)27-11-1-2-17(28)13-27/h3-10,12,17,28H,1-2,11,13H2,(H2,23,24,25)