4-(4-methoxyphenyl)-5-(methylsulfanylmethyl)pyrimidin-2-amine

Systemtic Name: 4-(4-methoxyphenyl)-5-(methylsulfanylmethyl)pyrimidin-2-amine Openeye Name: 4-(4-methoxyphenyl)-5-(methylsulfanylmethyl)pyrimidin-2-amine CAS Name: 4-(4-methoxyphenyl)-5-[(methylthio)methyl]-2-pyrimidinamine IUPAC Name: 4-(4-methoxyphenyl)-5-(methylsulfanylmethyl)pyrimidin-2-amine Traditional Name: [4-(4-methoxyphenyl)-5-[(methylthio)methyl]pyrimidin-2-yl]amine Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC=C2CSC)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC=C2CSC)N

InChI

InChI=1S/C13H15N3OS/c1-17-11-5-3-9(4-6-11)12-10(8-18-2)7-15-13(14)16-12/h3-7H,8H2,1-2H3,(H2,14,15,16)