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

Systemtic Name: (E)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-phenyl-prop-2-enoate Openeye Name: (E)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-phenyl-prop-2-enoate CAS Name: (E)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-phenyl-2-propenoate IUPAC Name: (E)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-phenylprop-2-enoate Traditional Name: (E)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-phenyl-acrylate Formula: C12H10N3O2S- MolecularWeight: 260.2917

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O2S/c1-8-13-12(15-14-8)18-10(11(16)17)7-9-5-3-2-4-6-9/h2-7H,1H3,(H,16,17)(H,13,14,15)/p-1/b10-7+