3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(4-ethylsulfonylphenyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(4-ethylsulfonylphenyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(4-ethylsulfonylphenyl)propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-(4-ethylsulfonylphenyl)propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(4-ethylsulfonylphenyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(4-esylphenyl)propionamide Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C18H23N3O3S2/c1-5-26(23,24)15-8-6-14(7-9-15)21-17(22)11-10-16-12(2)19-18(25-4)20-13(16)3/h6-9H,5,10-11H2,1-4H3,(H,21,22)