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

Systemtic Name: 4-[4-[4-ethyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Openeye Name: 4-[4-(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[4-[4-ethyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[4-(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[4-[5-(benzylthio)-4-ethyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N4O3S2/c1-2-25-20(22-23-21(25)29-16-17-6-4-3-5-7-17)18-8-10-19(11-9-18)30(26,27)24-12-14-28-15-13-24/h3-11H,2,12-16H2,1H3