N-[4-[4-ethyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[4-ethyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Openeye Name: N-[4-[4-ethyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide CAS Name: N-[4-[4-ethyl-5-(2-oxolanylmethylthio)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide IUPAC Name: N-[4-[4-ethyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Traditional Name: N-[4-[4-ethyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2CCCO2)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CCN1C(=NN=C1SCC2CCCO2)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C16H22N4O3S2/c1-3-20-15(12-6-8-13(9-7-12)19-25(2,21)22)17-18-16(20)24-11-14-5-4-10-23-14/h6-9,14,19H,3-5,10-11H2,1-2H3