2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]ethanoic acid

Systemtic Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]ethanoic acid Openeye Name: 2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]acetic acid CAS Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]acetic acid IUPAC Name: 2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]acetic acid Traditional Name: 2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]acetic acid Formula: C11H11N3O3S MolecularWeight: 265.28834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)COCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)COCC(=O)O

InChI

InChI=1S/C11H11N3O3S/c15-10(16)7-17-6-9-12-13-11(18)14(9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,13,18)(H,15,16)