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

Systemtic Name: 4-[3-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(4-pentyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(4-amyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C18H26N4O3S2 MolecularWeight: 410.55404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCCCN1C=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H26N4O3S2/c1-2-3-4-8-21-15-19-20-18(21)26-14-16-6-5-7-17(13-16)27(23,24)22-9-11-25-12-10-22/h5-7,13,15H,2-4,8-12,14H2,1H3