5-[phenyl-(4-propoxyphenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[phenyl-(4-propoxyphenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[phenyl-(4-propoxyphenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[phenyl-(4-propoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[phenyl-(4-propoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[phenyl-(4-propoxyphenyl)methyl]pyrimidin-4-yl]amine Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN=C(N=C3N)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN=C(N=C3N)N

InChI

InChI=1S/C20H22N4O/c1-2-12-25-16-10-8-15(9-11-16)18(14-6-4-3-5-7-14)17-13-23-20(22)24-19(17)21/h3-11,13,18H,2,12H2,1H3,(H4,21,22,23,24)