N-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)methyl]-1-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)methyl]-1-methylsulfonyl-methanesulfonamide Openeye Name: N-[(5-methyl-2-phenyl-triazol-4-yl)methyl]-1-methylsulfonyl-methanesulfonamide CAS Name: N-[(5-methyl-2-phenyl-4-triazolyl)methyl]-1-methylsulfonylmethanesulfonamide IUPAC Name: N-[(5-methyl-2-phenyltriazol-4-yl)methyl]-1-methylsulfonylmethanesulfonamide Traditional Name: 1-mesyl-N-[(5-methyl-2-phenyl-triazol-4-yl)methyl]methanesulfonamide Formula: C12H16N4O4S2 MolecularWeight: 344.40984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1CNS(=O)(=O)CS(=O)(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(N=C1CNS(=O)(=O)CS(=O)(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C12H16N4O4S2/c1-10-12(8-13-22(19,20)9-21(2,17)18)15-16(14-10)11-6-4-3-5-7-11/h3-7,13H,8-9H2,1-2H3