4-(3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)-N,N-bis(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-(3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)-N,N-bis(phenylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-(3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)benzenesulfonamide CAS Name: 4-[3-(ethylthio)-5-phenyl-1,2,4-triazol-4-yl]-N,N-bis(phenylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-(3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)benzenesulfonamide Traditional Name: N,N-dibenzyl-4-[3-(ethylthio)-5-phenyl-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C30H28N4O2S2 MolecularWeight: 540.69892

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H28N4O2S2/c1-2-37-30-32-31-29(26-16-10-5-11-17-26)34(30)27-18-20-28(21-19-27)38(35,36)33(22-24-12-6-3-7-13-24)23-25-14-8-4-9-15-25/h3-21H,2,22-23H2,1H3