2-bromanyl-N-[5-(3-iodanylphenyl)-1,3,4-thiadiazol-2-yl]-6-methyl-benzamide

Systemtic Name: 2-bromanyl-N-[5-(3-iodanylphenyl)-1,3,4-thiadiazol-2-yl]-6-methyl-benzamide Openeye Name: 2-bromo-N-[5-(3-iodophenyl)-1,3,4-thiadiazol-2-yl]-6-methyl-benzamide CAS Name: 2-bromo-N-[5-(3-iodophenyl)-1,3,4-thiadiazol-2-yl]-6-methylbenzamide IUPAC Name: 2-bromo-N-[5-(3-iodophenyl)-1,3,4-thiadiazol-2-yl]-6-methylbenzamide Traditional Name: 2-bromo-N-[5-(3-iodophenyl)-1,3,4-thiadiazol-2-yl]-6-methyl-benzamide Formula: C16H11BrIN3OS MolecularWeight: 500.15151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Br)C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)I

Isomeric SMILES

CC1=C(C(=CC=C1)Br)C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)I

InChI

InChI=1S/C16H11BrIN3OS/c1-9-4-2-7-12(17)13(9)14(22)19-16-21-20-15(23-16)10-5-3-6-11(18)8-10/h2-8H,1H3,(H,19,21,22)