4-[3-[4-prop-2-enyl-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[4-prop-2-enyl-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[4-allyl-5-[2-(4-pyridyl)ethylsulfanyl]-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-prop-2-enyl-5-(2-pyridin-4-ylethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[4-prop-2-enyl-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-allyl-5-[2-(4-pyridyl)ethylthio]-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C22H25N5O3S2 MolecularWeight: 471.5956

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCCC2=CC=NC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C=CCN1C(=NN=C1SCCC2=CC=NC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25N5O3S2/c1-2-11-27-21(24-25-22(27)31-16-8-18-6-9-23-10-7-18)19-4-3-5-20(17-19)32(28,29)26-12-14-30-15-13-26/h2-7,9-10,17H,1,8,11-16H2