5-[[3-[4-(diethylamino)phenyl]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-[4-(diethylamino)phenyl]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-[4-(diethylamino)phenyl]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-[4-(diethylamino)phenyl]-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-[4-(diethylamino)phenyl]-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]phenyl]-diethyl-amine Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2=CC(=CC(=C2OC)OC)CC3=CN=C(N=C3N)N

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2=CC(=CC(=C2OC)OC)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C23H29N5O2/c1-5-28(6-2)18-9-7-16(8-10-18)19-12-15(13-20(29-3)21(19)30-4)11-17-14-26-23(25)27-22(17)24/h7-10,12-14H,5-6,11H2,1-4H3,(H4,24,25,26,27)