N,N-diethyl-3-[5-ethylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[5-ethylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: 3-(4-benzyl-5-ethylsulfanyl-1,2,4-triazol-3-yl)-N,N-diethyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[5-(ethylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: 3-(4-benzyl-5-ethylsulfanyl-1,2,4-triazol-3-yl)-N,N-diethylbenzenesulfonamide Traditional Name: 3-[4-benzyl-5-(ethylthio)-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC

InChI

InChI=1S/C21H26N4O2S2/c1-4-24(5-2)29(26,27)19-14-10-13-18(15-19)20-22-23-21(28-6-3)25(20)16-17-11-8-7-9-12-17/h7-15H,4-6,16H2,1-3H3