N,N-diethyl-3-[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: 3-[4-allyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: 3-[4-allyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C23H28N4O2S2 MolecularWeight: 456.62402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N4O2S2/c1-5-15-27-22(24-25-23(27)30-17-19-13-11-18(4)12-14-19)20-9-8-10-21(16-20)31(28,29)26(6-2)7-3/h5,8-14,16H,1,6-7,15,17H2,2-4H3