3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid

Systemtic Name: 3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid Openeye Name: 3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid CAS Name: 3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid IUPAC Name: 3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid Traditional Name: 3-[[5-(4-acetamidophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NN(C(=NC3=CC=CC(=C3)C(=O)O)S2)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NN(C(=NC3=CC=CC(=C3)C(=O)O)S2)C

InChI

InChI=1S/C18H16N4O3S/c1-11(23)19-14-8-6-12(7-9-14)16-21-22(2)18(26-16)20-15-5-3-4-13(10-15)17(24)25/h3-10H,1-2H3,(H,19,23)(H,24,25)