4-[[5-(5-chloranyl-2-methoxy-phenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate

Systemtic Name: 4-[[5-(5-chloranyl-2-methoxy-phenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate Openeye Name: 4-[[5-(5-chloro-2-methoxy-phenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate CAS Name: 4-[[5-(5-chloro-2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate IUPAC Name: 4-[[5-(5-chloro-2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate Traditional Name: 4-[[5-(5-chloro-2-methoxy-phenyl)-1,3,4-thiadiazol-2-yl]amino]benzoate Formula: C16H11ClN3O3S- MolecularWeight: 360.79484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NN=C(S2)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NN=C(S2)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H12ClN3O3S/c1-23-13-7-4-10(17)8-12(13)14-19-20-16(24-14)18-11-5-2-9(3-6-11)15(21)22/h2-8H,1H3,(H,18,20)(H,21,22)/p-1