1-(1,3-dimethyl-5-methylsulfanyl-pyrazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione

Systemtic Name: 1-(1,3-dimethyl-5-methylsulfanyl-pyrazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione Openeye Name: 1-(1,3-dimethyl-5-methylsulfanyl-pyrazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione CAS Name: 1-[1,3-dimethyl-5-(methylthio)-4-pyrazolyl]-4-phenyl-1,2,4-triazolidine-3,5-dione IUPAC Name: 1-(1,3-dimethyl-5-methylsulfanylpyrazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione Traditional Name: 1-[1,3-dimethyl-5-(methylthio)pyrazol-4-yl]-4-phenyl-urazole Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N2C(=O)N(C(=O)N2)C3=CC=CC=C3)SC)C

Isomeric SMILES

CC1=NN(C(=C1N2C(=O)N(C(=O)N2)C3=CC=CC=C3)SC)C

InChI

InChI=1S/C14H15N5O2S/c1-9-11(12(22-3)17(2)15-9)19-14(21)18(13(20)16-19)10-7-5-4-6-8-10/h4-8H,1-3H3,(H,16,20)