4-[5-ethanoyl-2-(phenylcarbonylimino)-1,3,4-thiadiazol-3-yl]benzoic acid

Systemtic Name: 4-[5-ethanoyl-2-(phenylcarbonylimino)-1,3,4-thiadiazol-3-yl]benzoic acid Openeye Name: 4-(5-acetyl-2-benzoylimino-1,3,4-thiadiazol-3-yl)benzoic acid CAS Name: 4-(5-acetyl-2-benzoylimino-1,3,4-thiadiazol-3-yl)benzoic acid IUPAC Name: 4-(5-acetyl-2-benzoylimino-1,3,4-thiadiazol-3-yl)benzoic acid Traditional Name: 4-(5-acetyl-2-benzoylimino-1,3,4-thiadiazol-3-yl)benzoic acid Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=NC(=O)C2=CC=CC=C2)S1)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)C1=NN(C(=NC(=O)C2=CC=CC=C2)S1)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H13N3O4S/c1-11(22)16-20-21(14-9-7-13(8-10-14)17(24)25)18(26-16)19-15(23)12-5-3-2-4-6-12/h2-10H,1H3,(H,24,25)