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

Systemtic Name: 6-butoxy-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-methylsulfanyl-N2-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2-benzyl-6-butoxy-N4-[2-(diisopropylamino)ethyl]-N2-methyl-5-methylsulfanyl-pyrimidine-2,4-diamine CAS Name: 6-butoxy-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-(methylthio)-N2-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-benzyl-6-butoxy-4-N-[2-[di(propan-2-yl)amino]ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine Traditional Name: benzyl-[4-butoxy-6-[2-(diisopropylamino)ethylamino]-5-(methylthio)pyrimidin-2-yl]-methyl-amine Formula: C25H41N5OS MolecularWeight: 459.69094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC(=C1SC)NCCN(C(C)C)C(C)C)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCOC1=NC(=NC(=C1SC)NCCN(C(C)C)C(C)C)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C25H41N5OS/c1-8-9-17-31-24-22(32-7)23(26-15-16-30(19(2)3)20(4)5)27-25(28-24)29(6)18-21-13-11-10-12-14-21/h10-14,19-20H,8-9,15-18H2,1-7H3,(H,26,27,28)