2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[3-methyl-4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-methyl-4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(3-methyl-4-pyrrolidino-phenyl)acetamide Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=C(C=C2)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=C(C=C2)N3CCCC3)C)C

InChI

InChI=1S/C19H24N4OS/c1-13-10-16(6-7-17(13)23-8-4-5-9-23)22-18(24)12-25-19-20-14(2)11-15(3)21-19/h6-7,10-11H,4-5,8-9,12H2,1-3H3,(H,22,24)