6-(2-dimethylaminoethyloxymethyl)-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-methylsulfanyl-N2-phenyl-pyrimidine-2,4-diamine

Systemtic Name: 6-(2-dimethylaminoethyloxymethyl)-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-methylsulfanyl-N2-phenyl-pyrimidine-2,4-diamine Openeye Name: N4-[2-(diisopropylamino)ethyl]-6-(2-dimethylaminoethyloxymethyl)-N2-methyl-5-methylsulfanyl-N2-phenyl-pyrimidine-2,4-diamine CAS Name: 6-(2-dimethylaminoethyloxymethyl)-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-(methylthio)-N2-phenylpyrimidine-2,4-diamine IUPAC Name: 6-(2-dimethylaminoethyloxymethyl)-4-N-[2-[di(propan-2-yl)amino]ethyl]-2-N-methyl-5-methylsulfanyl-2-N-phenylpyrimidine-2,4-diamine Traditional Name: [4-[2-(diisopropylamino)ethylamino]-6-(2-dimethylaminoethyloxymethyl)-5-(methylthio)pyrimidin-2-yl]-methyl-phenyl-amine Formula: C25H42N6OS MolecularWeight: 474.70558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC1=NC(=NC(=C1SC)COCCN(C)C)N(C)C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC(C)N(CCNC1=NC(=NC(=C1SC)COCCN(C)C)N(C)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C25H42N6OS/c1-19(2)31(20(3)4)15-14-26-24-23(33-8)22(18-32-17-16-29(5)6)27-25(28-24)30(7)21-12-10-9-11-13-21/h9-13,19-20H,14-18H2,1-8H3,(H,26,27,28)