6-[(4-bromophenyl)sulfanylmethyl]-2-[(4-methoxyphenyl)methylsulfanyl]-N-methyl-pyrimidin-4-amine

Systemtic Name: 6-[(4-bromophenyl)sulfanylmethyl]-2-[(4-methoxyphenyl)methylsulfanyl]-N-methyl-pyrimidin-4-amine Openeye Name: 6-[(4-bromophenyl)sulfanylmethyl]-2-[(4-methoxyphenyl)methylsulfanyl]-N-methyl-pyrimidin-4-amine CAS Name: 6-[[(4-bromophenyl)thio]methyl]-2-[(4-methoxyphenyl)methylthio]-N-methyl-4-pyrimidinamine IUPAC Name: 6-[(4-bromophenyl)sulfanylmethyl]-2-[(4-methoxyphenyl)methylsulfanyl]-N-methylpyrimidin-4-amine Traditional Name: [6-[[(4-bromophenyl)thio]methyl]-2-(p-anisylthio)pyrimidin-4-yl]-methyl-amine Formula: C20H20BrN3OS2 MolecularWeight: 462.4263

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Br)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Br)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20BrN3OS2/c1-22-19-11-16(13-26-18-9-5-15(21)6-10-18)23-20(24-19)27-12-14-3-7-17(25-2)8-4-14/h3-11H,12-13H2,1-2H3,(H,22,23,24)