2-[4-chloranyl-6-(2,3-dimethylphenyl)pyrimidin-2-yl]-N-(2-hydroxyethyl)ethanethioamide

Systemtic Name: 2-[4-chloranyl-6-(2,3-dimethylphenyl)pyrimidin-2-yl]-N-(2-hydroxyethyl)ethanethioamide Openeye Name: 2-[4-chloro-6-(2,3-dimethylphenyl)pyrimidin-2-yl]-N-(2-hydroxyethyl)thioacetamide CAS Name: 2-[4-chloro-6-(2,3-dimethylphenyl)-2-pyrimidinyl]-N-(2-hydroxyethyl)ethanethioamide IUPAC Name: 2-[4-chloro-6-(2,3-dimethylphenyl)pyrimidin-2-yl]-N-(2-hydroxyethyl)ethanethioamide Traditional Name: 2-[4-chloro-6-(2,3-dimethylphenyl)pyrimidin-2-yl]-N-(2-hydroxyethyl)thioacetamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C2=CC(=NC(=N2)CC(=S)NCCO)Cl

Isomeric SMILES

CC1=CC=CC(=C1C)C2=CC(=NC(=N2)CC(=S)NCCO)Cl

InChI

InChI=1S/C16H18ClN3OS/c1-10-4-3-5-12(11(10)2)13-8-14(17)20-15(19-13)9-16(22)18-6-7-21/h3-5,8,21H,6-7,9H2,1-2H3,(H,18,22)