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

Systemtic Name: 1-[4-[5-(2-azanylpyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]pyrrolidin-3-ol Openeye Name: 1-[4-[5-(2-aminopyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]pyrrolidin-3-ol CAS Name: 1-[4-[5-(2-amino-4-pyrimidinyl)-2,1-benzoxazol-3-yl]phenyl]-3-pyrrolidinol IUPAC Name: 1-[4-[5-(2-aminopyrimidin-4-yl)-2,1-benzoxazol-3-yl]phenyl]pyrrolidin-3-ol Traditional Name: 1-[4-[5-(2-aminopyrimidin-4-yl)anthranil-3-yl]phenyl]pyrrolidin-3-ol Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N

Isomeric SMILES

C1CN(CC1O)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NO3)C5=NC(=NC=C5)N

InChI

InChI=1S/C21H19N5O2/c22-21-23-9-7-18(24-21)14-3-6-19-17(11-14)20(28-25-19)13-1-4-15(5-2-13)26-10-8-16(27)12-26/h1-7,9,11,16,27H,8,10,12H2,(H2,22,23,24)