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

Systemtic Name: 4-[1-ethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C23H26N6O3S2 MolecularWeight: 498.62094

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NN=C(N4C5=CC=CC=C5)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NN=C(N4C5=CC=CC=C5)C

InChI

InChI=1S/C23H26N6O3S2/c1-3-28-21-10-9-19(34(30,31)27-11-13-32-14-12-27)15-20(21)24-22(28)16-33-23-26-25-17(2)29(23)18-7-5-4-6-8-18/h4-10,15H,3,11-14,16H2,1-2H3