6-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 6-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: 6-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanyl-pyrimidin-4-amine CAS Name: 6-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(methylthio)-4-pyrimidinamine IUPAC Name: 6-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylsulfanylpyrimidin-4-amine Traditional Name: [6-(3,4-dimethoxyphenyl)-2-(methylthio)pyrimidin-4-yl]-homoveratryl-amine Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC(=NC(=C2)C3=CC(=C(C=C3)OC)OC)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC(=NC(=C2)C3=CC(=C(C=C3)OC)OC)SC)OC

InChI

InChI=1S/C23H27N3O4S/c1-27-18-8-6-15(12-20(18)29-3)10-11-24-22-14-17(25-23(26-22)31-5)16-7-9-19(28-2)21(13-16)30-4/h6-9,12-14H,10-11H2,1-5H3,(H,24,25,26)