3-[5-(cyanomethylsulfanyl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[5-(cyanomethylsulfanyl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[5-(cyanomethylsulfanyl)-4-(m-tolyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[5-(cyanomethylthio)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[5-(cyanomethylsulfanyl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[5-(cyanomethylthio)-4-(m-tolyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Formula: C19H19N5O2S2 MolecularWeight: 413.51646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC#N)C3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC#N)C3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C19H19N5O2S2/c1-14-6-4-8-16(12-14)24-18(21-22-19(24)27-11-10-20)15-7-5-9-17(13-15)28(25,26)23(2)3/h4-9,12-13H,11H2,1-3H3