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

Systemtic Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-(2-methoxyphenyl)-5-(2-methylsulfanylphenyl)pyrimidine-2,4-diamine Openeye Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-(2-methoxyphenyl)-5-(2-methylsulfanylphenyl)pyrimidine-2,4-diamine CAS Name: N2-[4-(2-diethylaminoethyloxy)phenyl]-N4-(2-methoxyphenyl)-5-[2-(methylthio)phenyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[4-(2-diethylaminoethyloxy)phenyl]-4-N-(2-methoxyphenyl)-5-(2-methylsulfanylphenyl)pyrimidine-2,4-diamine Traditional Name: diethyl-[2-[4-[[5-[2-(methylthio)phenyl]-4-(o-anisidino)pyrimidin-2-yl]amino]phenoxy]ethyl]amine Formula: C30H35N5O2S MolecularWeight: 529.6962

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3OC)C4=CC=CC=C4SC

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3OC)C4=CC=CC=C4SC

InChI

InChI=1S/C30H35N5O2S/c1-5-35(6-2)19-20-37-23-17-15-22(16-18-23)32-30-31-21-25(24-11-7-10-14-28(24)38-4)29(34-30)33-26-12-8-9-13-27(26)36-3/h7-18,21H,5-6,19-20H2,1-4H3,(H2,31,32,33,34)