4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-2-[(3-phenylmethoxyphenyl)amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-2-[(3-phenylmethoxyphenyl)amino]pyrimidine-5-carbonitrile Openeye Name: 2-(3-benzyloxyanilino)-4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)pyrimidine-5-carbonitrile CAS Name: 4-(3-cyclohexyl-5-methyl-4-isoxazolyl)-2-(3-phenylmethoxyanilino)-5-pyrimidinecarbonitrile IUPAC Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-2-(3-phenylmethoxyanilino)pyrimidine-5-carbonitrile Traditional Name: 2-(3-benzoxyanilino)-4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)pyrimidine-5-carbonitrile Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3C#N)NC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3C#N)NC4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H27N5O2/c1-19-25(27(33-35-19)21-11-6-3-7-12-21)26-22(16-29)17-30-28(32-26)31-23-13-8-14-24(15-23)34-18-20-9-4-2-5-10-20/h2,4-5,8-10,13-15,17,21H,3,6-7,11-12,18H2,1H3,(H,30,31,32)