N-[5-(4-bromanyl-2-chloranyl-phenyl)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[5-(4-bromanyl-2-chloranyl-phenyl)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide Openeye Name: N-[5-(4-bromo-2-chloro-phenyl)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide CAS Name: N-[5-(4-bromo-2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide IUPAC Name: N-[5-(4-bromo-2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide Traditional Name: N-[5-(4-bromo-2-chloro-phenyl)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide Formula: C16H11BrClN3O2S MolecularWeight: 424.69944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=NN=C(S2)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=NN=C(S2)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H11BrClN3O2S/c1-23-13-5-3-2-4-11(13)14(22)19-16-21-20-15(24-16)10-7-6-9(17)8-12(10)18/h2-8H,1H3,(H,19,21,22)