3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N5OS/c1-15-19(16(2)24-21(23-15)28-4)10-11-20(27)25(3)13-17-12-22-26(14-17)18-8-6-5-7-9-18/h5-9,12,14H,10-11,13H2,1-4H3