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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N

Isomeric SMILES

C1CN(CCC1O)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N

InChI

InChI=1S/C22H21N5O2/c23-22-24-10-7-19(25-22)15-3-6-20-18(13-15)21(29-26-20)14-1-4-16(5-2-14)27-11-8-17(28)9-12-27/h1-7,10,13,17,28H,8-9,11-12H2,(H2,23,24,25)