N-(2-chlorophenyl)-3-[5-(2-oxidanylidenepropylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N-(2-chlorophenyl)-3-[5-(2-oxidanylidenepropylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: 3-(5-acetonylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)-N-(2-chlorophenyl)benzenesulfonamide CAS Name: N-(2-chlorophenyl)-3-[5-(2-oxopropylthio)-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N-(2-chlorophenyl)-3-[5-(2-oxopropylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: 3-[5-(acetonylthio)-4-phenyl-1,2,4-triazol-3-yl]-N-(2-chlorophenyl)benzenesulfonamide Formula: C23H19ClN4O3S2 MolecularWeight: 499.00496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

CC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C23H19ClN4O3S2/c1-16(29)15-32-23-26-25-22(28(23)18-9-3-2-4-10-18)17-8-7-11-19(14-17)33(30,31)27-21-13-6-5-12-20(21)24/h2-14,27H,15H2,1H3