2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-ethynylphenyl)ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-ethynylphenyl)ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-ethynylphenyl)acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(3-ethynylphenyl)acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-ethynylphenyl)acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(3-ethynylphenyl)acetamide Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3OS/c1-4-13-6-5-7-14(9-13)19-15(20)10-21-16-17-11(2)8-12(3)18-16/h1,5-9H,10H2,2-3H3,(H,19,20)