4-butyl-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[(2-ethylthiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[(2-ethyl-4-thiazolyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[(2-ethylthiazol-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C12H18N4OS2 MolecularWeight: 298.42752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC2=CSC(=N2)CC

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC2=CSC(=N2)CC

InChI

InChI=1S/C12H18N4OS2/c1-3-5-6-16-11(17)14-15-12(16)19-8-9-7-18-10(4-2)13-9/h7H,3-6,8H2,1-2H3,(H,14,17)