(E)-3-(4-methylsulfanylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate

Systemtic Name: (E)-3-(4-methylsulfanylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Openeye Name: (E)-3-(4-methylsulfanylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate CAS Name: (E)-3-[4-(methylthio)phenyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoate IUPAC Name: (E)-3-(4-methylsulfanylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Traditional Name: (E)-3-[4-(methylthio)phenyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acrylate Formula: C13H12N3O2S2- MolecularWeight: 306.38328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SC(=CC2=CC=C(C=C2)SC)C(=O)[O-]

Isomeric SMILES

CC1=NC(=NN1)S/C(=C/C2=CC=C(C=C2)SC)/C(=O)[O-]

InChI

InChI=1S/C13H13N3O2S2/c1-8-14-13(16-15-8)20-11(12(17)18)7-9-3-5-10(19-2)6-4-9/h3-7H,1-2H3,(H,17,18)(H,14,15,16)/p-1/b11-7+