2-[4-[2-(1H-indazol-3-ylamino)-6-(phenylmethyl)pyrimidin-4-yl]oxyphenyl]ethanenitrile

Systemtic Name: 2-[4-[2-(1H-indazol-3-ylamino)-6-(phenylmethyl)pyrimidin-4-yl]oxyphenyl]ethanenitrile Openeye Name: 2-[4-[6-benzyl-2-(1H-indazol-3-ylamino)pyrimidin-4-yl]oxyphenyl]acetonitrile CAS Name: 2-[4-[[2-(1H-indazol-3-ylamino)-6-(phenylmethyl)-4-pyrimidinyl]oxy]phenyl]acetonitrile IUPAC Name: 2-[4-[6-benzyl-2-(1H-indazol-3-ylamino)pyrimidin-4-yl]oxyphenyl]acetonitrile Traditional Name: 2-[4-[6-benzyl-2-(1H-indazol-3-ylamino)pyrimidin-4-yl]oxyphenyl]acetonitrile Formula: C26H20N6O MolecularWeight: 432.4766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=NC(=N2)NC3=NNC4=CC=CC=C43)OC5=CC=C(C=C5)CC#N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=NC(=N2)NC3=NNC4=CC=CC=C43)OC5=CC=C(C=C5)CC#N

InChI

InChI=1S/C26H20N6O/c27-15-14-18-10-12-21(13-11-18)33-24-17-20(16-19-6-2-1-3-7-19)28-26(29-24)30-25-22-8-4-5-9-23(22)31-32-25/h1-13,17H,14,16H2,(H2,28,29,30,31,32)