2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanyl]-N-(4-iodanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanyl]-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)thio]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[(4-amino-5-keto-6-methyl-1,2,4-triazin-3-yl)thio]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C13H14IN5O2S MolecularWeight: 431.25203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NN=C(C(=O)N2N)C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NN=C(C(=O)N2N)C

InChI

InChI=1S/C13H14IN5O2S/c1-7-5-9(14)3-4-10(7)16-11(20)6-22-13-18-17-8(2)12(21)19(13)15/h3-5H,6,15H2,1-2H3,(H,16,20)