4-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C21H28N6O3S2 MolecularWeight: 476.61542

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NNC(=N4)C5CCCC5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NNC(=N4)C5CCCC5

InChI

InChI=1S/C21H28N6O3S2/c1-2-27-18-8-7-16(32(28,29)26-9-11-30-12-10-26)13-17(18)22-19(27)14-31-21-23-20(24-25-21)15-5-3-4-6-15/h7-8,13,15H,2-6,9-12,14H2,1H3,(H,23,24,25)