5-cyclohexyl-N4-[(2,3,4-trimethoxyphenyl)methyl]pyrimidine-2,4,6-triamine

Systemtic Name: 5-cyclohexyl-N4-[(2,3,4-trimethoxyphenyl)methyl]pyrimidine-2,4,6-triamine Openeye Name: 5-cyclohexyl-N4-[(2,3,4-trimethoxyphenyl)methyl]pyrimidine-2,4,6-triamine CAS Name: 5-cyclohexyl-N4-[(2,3,4-trimethoxyphenyl)methyl]pyrimidine-2,4,6-triamine IUPAC Name: 5-cyclohexyl-4-N-[(2,3,4-trimethoxyphenyl)methyl]pyrimidine-2,4,6-triamine Traditional Name: (2,6-diamino-5-cyclohexyl-pyrimidin-4-yl)-(2,3,4-trimethoxybenzyl)amine Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC2=NC(=NC(=C2C3CCCCC3)N)N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC2=NC(=NC(=C2C3CCCCC3)N)N)OC)OC

InChI

InChI=1S/C20H29N5O3/c1-26-14-10-9-13(16(27-2)17(14)28-3)11-23-19-15(12-7-5-4-6-8-12)18(21)24-20(22)25-19/h9-10,12H,4-8,11H2,1-3H3,(H5,21,22,23,24,25)