5-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanoyl]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanoyl]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[1-oxo-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]ethyl]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetyl]-1,3-dihydrobenzimidazol-2-one Formula: C16H16N4O2S MolecularWeight: 328.38884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)C2=CC3=C(C=C2)NC(=O)N3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)C2=CC3=C(C=C2)NC(=O)N3)C

InChI

InChI=1S/C16H16N4O2S/c1-8-9(2)17-16(18-10(8)3)23-7-14(21)11-4-5-12-13(6-11)20-15(22)19-12/h4-6H,7H2,1-3H3,(H2,19,20,22)