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

Systemtic Name: 6-butoxy-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-methylsulfanyl-N2-phenyl-pyrimidine-2,4-diamine hydrobromide Openeye Name: 6-butoxy-N4-[2-(diisopropylamino)ethyl]-N2-methyl-5-methylsulfanyl-N2-phenyl-pyrimidine-2,4-diamine hydrobromide CAS Name: 6-butoxy-N4-[2-[di(propan-2-yl)amino]ethyl]-N2-methyl-5-(methylthio)-N2-phenylpyrimidine-2,4-diamine hydrobromide IUPAC Name: 6-butoxy-4-N-[2-[di(propan-2-yl)amino]ethyl]-2-N-methyl-5-methylsulfanyl-2-N-phenylpyrimidine-2,4-diamine hydrobromide Traditional Name: [4-butoxy-6-[2-(diisopropylamino)ethylamino]-5-(methylthio)pyrimidin-2-yl]-methyl-phenyl-amine hydrobromide Formula: C24H40BrN5OS MolecularWeight: 526.5763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC(=C1SC)NCCN(C(C)C)C(C)C)N(C)C2=CC=CC=C2.Br

Isomeric SMILES

CCCCOC1=NC(=NC(=C1SC)NCCN(C(C)C)C(C)C)N(C)C2=CC=CC=C2.Br

InChI

InChI=1S/C24H39N5OS.BrH/c1-8-9-17-30-23-21(31-7)22(25-15-16-29(18(2)3)19(4)5)26-24(27-23)28(6)20-13-11-10-12-14-20;/h10-14,18-19H,8-9,15-17H2,1-7H3,(H,25,26,27);1H