N-[4-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanoyl]phenyl]benzamide

Systemtic Name: N-[4-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanoyl]phenyl]benzamide Openeye Name: N-[4-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]phenyl]benzamide CAS Name: N-[4-[1-oxo-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]ethyl]phenyl]benzamide IUPAC Name: N-[4-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]phenyl]benzamide Traditional Name: N-[4-[2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetyl]phenyl]benzamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H21N3O2S/c1-14-15(2)23-22(24-16(14)3)28-13-20(26)17-9-11-19(12-10-17)25-21(27)18-7-5-4-6-8-18/h4-12H,13H2,1-3H3,(H,25,27)