N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-3-methylsulfanyl-aniline

Systemtic Name: N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-3-methylsulfanyl-aniline Openeye Name: N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-3-methylsulfanyl-aniline CAS Name: N-[(4,6-dimethoxy-5-pyrimidinyl)methyl]-3-(methylthio)aniline IUPAC Name: N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-3-methylsulfanylaniline Traditional Name: (4,6-dimethoxypyrimidin-5-yl)methyl-[3-(methylthio)phenyl]amine Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=N1)OC)CNC2=CC(=CC=C2)SC

Isomeric SMILES

COC1=C(C(=NC=N1)OC)CNC2=CC(=CC=C2)SC

InChI

InChI=1S/C14H17N3O2S/c1-18-13-12(14(19-2)17-9-16-13)8-15-10-5-4-6-11(7-10)20-3/h4-7,9,15H,8H2,1-3H3