2-[(4,6-dimethoxypyrimidin-2-yl)-methylsulfanyl-methyl]-6-(methoxymethyl)aniline

Systemtic Name: 2-[(4,6-dimethoxypyrimidin-2-yl)-methylsulfanyl-methyl]-6-(methoxymethyl)aniline Openeye Name: 2-[(4,6-dimethoxypyrimidin-2-yl)-methylsulfanyl-methyl]-6-(methoxymethyl)aniline CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)-(methylthio)methyl]-6-(methoxymethyl)aniline IUPAC Name: 2-[(4,6-dimethoxypyrimidin-2-yl)-methylsulfanylmethyl]-6-(methoxymethyl)aniline Traditional Name: [2-[(4,6-dimethoxypyrimidin-2-yl)-(methylthio)methyl]-6-(methoxymethyl)phenyl]amine Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C(=CC=C1)C(C2=NC(=CC(=N2)OC)OC)SC)N

Isomeric SMILES

COCC1=C(C(=CC=C1)C(C2=NC(=CC(=N2)OC)OC)SC)N

InChI

InChI=1S/C16H21N3O3S/c1-20-9-10-6-5-7-11(14(10)17)15(23-4)16-18-12(21-2)8-13(19-16)22-3/h5-8,15H,9,17H2,1-4H3