4-[1-ethyl-2-(pyridin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-ethyl-2-(pyridin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-(2-pyridylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[(2-pyridinylthio)methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-(pyridin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[(2-pyridylthio)methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C19H22N4O3S2 MolecularWeight: 418.53298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=CC=CC=N4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=CC=CC=N4

InChI

InChI=1S/C19H22N4O3S2/c1-2-23-17-7-6-15(28(24,25)22-9-11-26-12-10-22)13-16(17)21-18(23)14-27-19-5-3-4-8-20-19/h3-8,13H,2,9-12,14H2,1H3