N,N-dimethyl-3-(phenylmethyl)sulfonyl-1,2,4-triazole-1-carboxamide

Systemtic Name: N,N-dimethyl-3-(phenylmethyl)sulfonyl-1,2,4-triazole-1-carboxamide Openeye Name: 3-benzylsulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide CAS Name: N,N-dimethyl-3-(phenylmethyl)sulfonyl-1,2,4-triazole-1-carboxamide IUPAC Name: 3-benzylsulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Traditional Name: 3-benzylsulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1C=NC(=N1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CN(C)C(=O)N1C=NC(=N1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H14N4O3S/c1-15(2)12(17)16-9-13-11(14-16)20(18,19)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3