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

Systemtic Name: 5-[(4-hexoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-hexoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-hexoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-hexoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-hexoxy-3-methoxy-benzyl)pyrimidin-4-yl]amine Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

InChI

InChI=1S/C18H26N4O2/c1-3-4-5-6-9-24-15-8-7-13(11-16(15)23-2)10-14-12-21-18(20)22-17(14)19/h7-8,11-12H,3-6,9-10H2,1-2H3,(H4,19,20,21,22)