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

Systemtic Name: 4-[2-[(4-methoxyphenyl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(4-methoxyphenyl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[[(4-methoxyphenyl)thio]methyl]-1-propyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(4-methoxyphenyl)sulfanylmethyl]-1-propylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[[(4-methoxyphenyl)thio]methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=CC=C(C=C4)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H27N3O4S2/c1-3-10-25-21-9-8-19(31(26,27)24-11-13-29-14-12-24)15-20(21)23-22(25)16-30-18-6-4-17(28-2)5-7-18/h4-9,15H,3,10-14,16H2,1-2H3