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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(2,4,5-trimethoxybenzyl)propionamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C20H27N3O4S/c1-12-15(13(2)23-20(22-12)28-6)7-8-19(24)21-11-14-9-17(26-4)18(27-5)10-16(14)25-3/h9-10H,7-8,11H2,1-6H3,(H,21,24)