5-[(4-butoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(4-butoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-butoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-butoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-butoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-butoxy-3-methoxy-benzyl)pyrimidin-4-yl]amine Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

InChI

InChI=1S/C16H22N4O2/c1-3-4-7-22-13-6-5-11(9-14(13)21-2)8-12-10-19-16(18)20-15(12)17/h5-6,9-10H,3-4,7-8H2,1-2H3,(H4,17,18,19,20)