3-bromanyl-N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]benzamide

Systemtic Name: 3-bromanyl-N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]benzamide Openeye Name: 3-bromo-N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]benzamide CAS Name: 3-bromo-N-[1-ethyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-5-benzimidazolyl]benzamide IUPAC Name: 3-bromo-N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]benzamide Traditional Name: 3-bromo-N-[1-ethyl-2-[[(4-methylpyrimidin-2-yl)thio]methyl]benzimidazol-5-yl]benzamide Formula: C22H20BrN5OS MolecularWeight: 482.3961

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CSC4=NC=CC(=N4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CSC4=NC=CC(=N4)C

InChI

InChI=1S/C22H20BrN5OS/c1-3-28-19-8-7-17(26-21(29)15-5-4-6-16(23)11-15)12-18(19)27-20(28)13-30-22-24-10-9-14(2)25-22/h4-12H,3,13H2,1-2H3,(H,26,29)