(3-ethanoyl-5-iodanyl-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-[(2-methylpropan-2-yl)oxy]carbamic acid

Systemtic Name: (3-ethanoyl-5-iodanyl-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-[(2-methylpropan-2-yl)oxy]carbamic acid Openeye Name: (3-acetyl-5-iodo-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-tert-butoxy-carbamic acid CAS Name: (3-acetyl-5-iodo-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-[(2-methylpropan-2-yl)oxy]carbamic acid IUPAC Name: (3-acetyl-5-iodo-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-[(2-methylpropan-2-yl)oxy]carbamic acid Traditional Name: (3-acetyl-5-iodo-2-phenyl-1,3,4-thiadiazol-2-yl)methyl-tert-butoxy-carbamic acid Formula: C16H20IN3O4S MolecularWeight: 477.31717

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)I)(CN(C(=O)O)OC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N1C(SC(=N1)I)(CN(C(=O)O)OC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C16H20IN3O4S/c1-11(21)20-16(25-13(17)18-20,12-8-6-5-7-9-12)10-19(14(22)23)24-15(2,3)4/h5-9H,10H2,1-4H3,(H,22,23)