N4-(3-cyclohexyl-1,2-oxazol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-(3-cyclohexyl-1,2-oxazol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Openeye Name: N4-(3-cyclohexylisoxazol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine CAS Name: N4-(3-cyclohexyl-5-isoxazolyl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-cyclohexyl-1,2-oxazol-5-yl)-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Traditional Name: (3-cyclohexylisoxazol-5-yl)-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amine Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)NC3=CC(=NO3)C4CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)NC3=CC(=NO3)C4CCCCC4

InChI

InChI=1S/C22H27N5O4/c1-28-17-11-15(12-18(29-2)21(17)30-3)24-22-23-10-9-19(26-22)25-20-13-16(27-31-20)14-7-5-4-6-8-14/h9-14H,4-8H2,1-3H3,(H2,23,24,25,26)