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

Systemtic Name: N4-[2-[di(propan-2-yl)amino]ethyl]-6-methoxy-N2-methyl-5-methylsulfanyl-N2-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2-benzyl-N4-[2-(diisopropylamino)ethyl]-6-methoxy-N2-methyl-5-methylsulfanyl-pyrimidine-2,4-diamine CAS Name: N4-[2-[di(propan-2-yl)amino]ethyl]-6-methoxy-N2-methyl-5-(methylthio)-N2-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-benzyl-4-N-[2-[di(propan-2-yl)amino]ethyl]-6-methoxy-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine Traditional Name: benzyl-[4-[2-(diisopropylamino)ethylamino]-6-methoxy-5-(methylthio)pyrimidin-2-yl]-methyl-amine Formula: C22H35N5OS MolecularWeight: 417.6112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC1=C(C(=NC(=N1)N(C)CC2=CC=CC=C2)OC)SC)C(C)C

Isomeric SMILES

CC(C)N(CCNC1=C(C(=NC(=N1)N(C)CC2=CC=CC=C2)OC)SC)C(C)C

InChI

InChI=1S/C22H35N5OS/c1-16(2)27(17(3)4)14-13-23-20-19(29-7)21(28-6)25-22(24-20)26(5)15-18-11-9-8-10-12-18/h8-12,16-17H,13-15H2,1-7H3,(H,23,24,25)