3-(3-cyclohexylsulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)propanoic acid

Systemtic Name: 3-(3-cyclohexylsulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)propanoic acid Openeye Name: 3-(3-cyclohexylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)propanoic acid CAS Name: 3-[3-(cyclohexylthio)-5-oxo-2H-1,2,4-triazin-6-yl]propanoic acid IUPAC Name: 3-(3-cyclohexylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)propanoic acid Traditional Name: 3-[3-(cyclohexylthio)-5-keto-2H-1,2,4-triazin-6-yl]propionic acid Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=NC(=O)C(=NN2)CCC(=O)O

Isomeric SMILES

C1CCC(CC1)SC2=NC(=O)C(=NN2)CCC(=O)O

InChI

InChI=1S/C12H17N3O3S/c16-10(17)7-6-9-11(18)13-12(15-14-9)19-8-4-2-1-3-5-8/h8H,1-7H2,(H,16,17)(H,13,15,18)