N-[4-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanoyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanoyl]phenyl]-2-methyl-propanamide Openeye Name: N-[4-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylacetyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[2-[(2,6-dimethyl-4-pyrimidinyl)thio]-1-oxoethyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylacetyl]phenyl]-2-methylpropanamide Traditional Name: N-[4-[2-[(2,6-dimethylpyrimidin-4-yl)thio]acetyl]phenyl]-2-methyl-propionamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2S/c1-11(2)18(23)21-15-7-5-14(6-8-15)16(22)10-24-17-9-12(3)19-13(4)20-17/h5-9,11H,10H2,1-4H3,(H,21,23)