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

Systemtic Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C21H30N4O3S2 MolecularWeight: 450.6179

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O3S2/c1-7-25(8-2)30(27,28)19-13-17(10-9-14(19)3)24-20(26)12-11-18-15(4)22-21(29-6)23-16(18)5/h9-10,13H,7-8,11-12H2,1-6H3,(H,24,26)