N,N-diethyl-3-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)benzenesulfonamide

Systemtic Name: N,N-diethyl-3-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)benzenesulfonamide Openeye Name: N,N-diethyl-3-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)benzenesulfonamide CAS Name: N,N-diethyl-3-[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)benzenesulfonamide Traditional Name: N,N-diethyl-3-[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

InChI

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