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

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetamide Traditional Name: 2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C13H13N5O5S MolecularWeight: 351.33782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H13N5O5S/c1-7-12(20)15-13(17-16-7)24-6-11(19)14-9-4-3-8(18(21)22)5-10(9)23-2/h3-5H,6H2,1-2H3,(H,14,19)(H,15,17,20)