1-ethanethioyl-5-methyl-2-phenyl-1,2,4-triazol-3-one

Systemtic Name: 1-ethanethioyl-5-methyl-2-phenyl-1,2,4-triazol-3-one Openeye Name: 1-ethanethioyl-5-methyl-2-phenyl-1,2,4-triazol-3-one CAS Name: 5-methyl-2-phenyl-1-(1-sulfanylideneethyl)-1,2,4-triazol-3-one IUPAC Name: 1-ethanethioyl-5-methyl-2-phenyl-1,2,4-triazol-3-one Traditional Name: 5-methyl-2-phenyl-1-thioacetyl-1,2,4-triazol-3-one Formula: C11H11N3OS MolecularWeight: 233.28954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N(N1C(=S)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=O)N(N1C(=S)C)C2=CC=CC=C2

InChI

InChI=1S/C11H11N3OS/c1-8-12-11(15)14(13(8)9(2)16)10-6-4-3-5-7-10/h3-7H,1-2H3