4-[2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[[(1-methyl-2-benzimidazolyl)thio]methyl]-1-propyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1-propylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[[(1-methylbenzimidazol-2-yl)thio]methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C23H27N5O3S2 MolecularWeight: 485.62218

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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=C5N4C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC5=CC=CC=C5N4C

InChI

InChI=1S/C23H27N5O3S2/c1-3-10-28-21-9-8-17(33(29,30)27-11-13-31-14-12-27)15-19(21)24-22(28)16-32-23-25-18-6-4-5-7-20(18)26(23)2/h4-9,15H,3,10-14,16H2,1-2H3