N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-methylpropanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-methylpropanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-homoveratryl-N-methyl-propionamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H29N3O3S/c1-14-17(15(2)23-21(22-14)28-6)8-10-20(25)24(3)12-11-16-7-9-18(26-4)19(13-16)27-5/h7,9,13H,8,10-12H2,1-6H3