(Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid

Systemtic Name: (Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid Openeye Name: (Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid CAS Name: (Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoic acid IUPAC Name: (Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid Traditional Name: (Z)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acrylic acid Formula: C11H9N3O2S MolecularWeight: 247.27306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SC=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)S/C=C\C(=O)O

InChI

InChI=1S/C11H9N3O2S/c15-9(16)6-7-17-11-12-10(13-14-11)8-4-2-1-3-5-8/h1-7H,(H,15,16)(H,12,13,14)/b7-6-