N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodanyl-benzamide

Systemtic Name: N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodanyl-benzamide Openeye Name: N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodo-benzamide CAS Name: N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodobenzamide IUPAC Name: N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodobenzamide Traditional Name: N-[5-[2-(1H-imidazol-5-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-4-iodo-benzamide Formula: C14H13IN6OS MolecularWeight: 440.26209

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)NCCC3=CN=CN3)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)NCCC3=CN=CN3)I

InChI

InChI=1S/C14H13IN6OS/c15-10-3-1-9(2-4-10)12(22)19-14-21-20-13(23-14)17-6-5-11-7-16-8-18-11/h1-4,7-8H,5-6H2,(H,16,18)(H,17,20)(H,19,21,22)