N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-[(2-methoxyphenyl)methyl]-5-pyrimidin-5-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-[(2-methoxyphenyl)methyl]-5-pyrimidin-5-yl-pyrimidine-2,4-diamine Openeye Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-[(2-methoxyphenyl)methyl]-5-pyrimidin-5-yl-pyrimidine-2,4-diamine CAS Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-[(2-methoxyphenyl)methyl]-5-(5-pyrimidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[4-(2-diethylaminoethyloxy)phenyl]-4-N-[(2-methoxyphenyl)methyl]-5-pyrimidin-5-ylpyrimidine-2,4-diamine Traditional Name: diethyl-[2-[4-[[4-(o-anisylamino)-5-(5-pyrimidyl)pyrimidin-2-yl]amino]phenoxy]ethyl]amine Formula: C28H33N7O2 MolecularWeight: 499.60732

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC3=CC=CC=C3OC)C4=CN=CN=C4

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC3=CC=CC=C3OC)C4=CN=CN=C4

InChI

InChI=1S/C28H33N7O2/c1-4-35(5-2)14-15-37-24-12-10-23(11-13-24)33-28-32-19-25(22-16-29-20-30-17-22)27(34-28)31-18-21-8-6-7-9-26(21)36-3/h6-13,16-17,19-20H,4-5,14-15,18H2,1-3H3,(H2,31,32,33,34)