2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodophenyl)ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodophenyl)ethanamide Openeye Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodophenyl)acetamide CAS Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(4-iodophenyl)acetamide IUPAC Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodophenyl)acetamide Traditional Name: 2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(4-iodophenyl)acetamide Formula: C13H13IN4O2S MolecularWeight: 416.23739

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C13H13IN4O2S/c14-8-1-3-9(4-2-8)15-11(19)7-21-13-17-16-12(20)18(13)10-5-6-10/h1-4,10H,5-7H2,(H,15,19)(H,16,20)