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

Systemtic Name: 4-[1-ethyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[(2-pyrimidinylthio)methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[(2-pyrimidylthio)methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C18H21N5O3S2 MolecularWeight: 419.52104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O3S2/c1-2-23-16-5-4-14(28(24,25)22-8-10-26-11-9-22)12-15(16)21-17(23)13-27-18-19-6-3-7-20-18/h3-7,12H,2,8-11,13H2,1H3