1,3-dimethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylethanoyl]benzimidazol-2-one

Systemtic Name: 1,3-dimethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylethanoyl]benzimidazol-2-one Openeye Name: 1,3-dimethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylacetyl]benzimidazol-2-one CAS Name: 1,3-dimethyl-5-[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]ethyl]-2-benzimidazolone IUPAC Name: 1,3-dimethyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylacetyl]benzimidazol-2-one Traditional Name: 1,3-dimethyl-5-[2-[(6-phenylpyrimidin-4-yl)thio]acetyl]benzimidazol-2-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)CSC3=NC=NC(=C3)C4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)CSC3=NC=NC(=C3)C4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C21H18N4O2S/c1-24-17-9-8-15(10-18(17)25(2)21(24)27)19(26)12-28-20-11-16(22-13-23-20)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3