1-(azepan-1-yl)-2-(3-iodanyl-1,2,4-triazol-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(3-iodanyl-1,2,4-triazol-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(3-iodo-1,2,4-triazol-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(3-iodo-1,2,4-triazol-1-yl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(3-iodo-1,2,4-triazol-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(3-iodo-1,2,4-triazol-1-yl)ethanone Formula: C10H15IN4O MolecularWeight: 334.15677

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C=NC(=N2)I

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C=NC(=N2)I

InChI

InChI=1S/C10H15IN4O/c11-10-12-8-15(13-10)7-9(16)14-5-3-1-2-4-6-14/h8H,1-7H2