N-(4-iodanyl-2-propan-2-yl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(4-iodanyl-2-propan-2-yl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(4-iodo-2-isopropyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(4-iodo-2-propan-2-ylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(4-iodo-2-propan-2-ylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(4-iodo-2-isopropyl-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C13H15IN4OS MolecularWeight: 402.25387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)I)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)I)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C13H15IN4OS/c1-8(2)10-5-9(14)3-4-11(10)17-12(19)6-20-13-15-7-16-18-13/h3-5,7-8H,6H2,1-2H3,(H,17,19)(H,15,16,18)