5-aminocarbonylsulfanyl-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-aminocarbonylsulfanyl-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-carbamoylsulfanyl-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 5-(carbamoylthio)-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-carbamoylsulfanyl-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-(carbamoylthio)-4-(3-methoxypropyl)-1,2,4-triazole-3-carboxylic acid Formula: C8H12N4O4S MolecularWeight: 260.27028

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SC(=O)N)C(=O)O

Isomeric SMILES

COCCCN1C(=NN=C1SC(=O)N)C(=O)O

InChI

InChI=1S/C8H12N4O4S/c1-16-4-2-3-12-5(6(13)14)10-11-8(12)17-7(9)15/h2-4H2,1H3,(H2,9,15)(H,13,14)