4-[[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[[[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[[[2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[[[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[[[2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]acetyl]hydrazono]methyl]benzoic acid Formula: C12H11N5O3S2 MolecularWeight: 337.37744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)CSC2=NN=C(S2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C=NNC(=O)CSC2=NN=C(S2)N)C(=O)O

InChI

InChI=1S/C12H11N5O3S2/c13-11-16-17-12(22-11)21-6-9(18)15-14-5-7-1-3-8(4-2-7)10(19)20/h1-5H,6H2,(H2,13,16)(H,15,18)(H,19,20)