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

Systemtic Name: 5-[[3-butoxy-4-[(3,4,5-trimethoxyphenyl)methoxy]phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-butoxy-4-[(3,4,5-trimethoxyphenyl)methoxy]phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-butoxy-4-[(3,4,5-trimethoxyphenyl)methoxy]phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-butoxy-4-[(3,4,5-trimethoxyphenyl)methoxy]phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-butoxy-4-(3,4,5-trimethoxybenzyl)oxy-benzyl]pyrimidin-4-yl]amine Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OCC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C25H32N4O5/c1-5-6-9-33-20-11-16(10-18-14-28-25(27)29-24(18)26)7-8-19(20)34-15-17-12-21(30-2)23(32-4)22(13-17)31-3/h7-8,11-14H,5-6,9-10,15H2,1-4H3,(H4,26,27,28,29)