4-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-propyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-propyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[(1H-benzimidazol-2-ylthio)methyl]-1-propyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-propylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[(1H-benzimidazol-2-ylthio)methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C22H25N5O3S2 MolecularWeight: 471.5956

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H25N5O3S2/c1-2-9-27-20-8-7-16(32(28,29)26-10-12-30-13-11-26)14-19(20)23-21(27)15-31-22-24-17-5-3-4-6-18(17)25-22/h3-8,14H,2,9-13,15H2,1H3,(H,24,25)