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

Systemtic Name: N,N-dimethyl-3-(phenylmethylsulfanyl)-1,2,4-triazole-1-carboxamide Openeye Name: 3-benzylsulfanyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide CAS Name: N,N-dimethyl-3-(phenylmethylthio)-1,2,4-triazole-1-carboxamide IUPAC Name: 3-benzylsulfanyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Traditional Name: 3-(benzylthio)-N,N-dimethyl-1,2,4-triazole-1-carboxamide Formula: C12H14N4OS MolecularWeight: 262.33076

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1C=NC(=N1)SCC2=CC=CC=C2

Isomeric SMILES

CN(C)C(=O)N1C=NC(=N1)SCC2=CC=CC=C2

InChI

InChI=1S/C12H14N4OS/c1-15(2)12(17)16-9-13-11(14-16)18-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3