5-[(3,5-ditert-butyl-4-methoxy-phenyl)methyl]pyrimidine-2,4,6-triamine

Systemtic Name: 5-[(3,5-ditert-butyl-4-methoxy-phenyl)methyl]pyrimidine-2,4,6-triamine Openeye Name: 5-[(3,5-ditert-butyl-4-methoxy-phenyl)methyl]pyrimidine-2,4,6-triamine CAS Name: 5-[(3,5-ditert-butyl-4-methoxyphenyl)methyl]pyrimidine-2,4,6-triamine IUPAC Name: 5-[(3,5-ditert-butyl-4-methoxyphenyl)methyl]pyrimidine-2,4,6-triamine Traditional Name: [2,6-diamino-5-(3,5-ditert-butyl-4-methoxy-benzyl)pyrimidin-4-yl]amine Formula: C20H31N5O MolecularWeight: 357.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)CC2=C(N=C(N=C2N)N)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)CC2=C(N=C(N=C2N)N)N

InChI

InChI=1S/C20H31N5O/c1-19(2,3)13-9-11(10-14(15(13)26-7)20(4,5)6)8-12-16(21)24-18(23)25-17(12)22/h9-10H,8H2,1-7H3,(H6,21,22,23,24,25)