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

Systemtic Name: 4-[3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3S2/c30-34(31,28-14-16-32-17-15-28)23-13-7-8-20(18-23)19-33-25-27-26-24(21-9-3-1-4-10-21)29(25)22-11-5-2-6-12-22/h1-13,18H,14-17,19H2