2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]sulfanyl]acetic acid CAS Name: 2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]thio]acetic acid IUPAC Name: 2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[6-(4-acetamidophenyl)-5-methyl-1,2,4-triazin-3-yl]thio]acetic acid Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NC(=N1)SCC(=O)O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=C(N=NC(=N1)SCC(=O)O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C14H14N4O3S/c1-8-13(17-18-14(15-8)22-7-12(20)21)10-3-5-11(6-4-10)16-9(2)19/h3-6H,7H2,1-2H3,(H,16,19)(H,20,21)