3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(2-oxo-2-thiophen-2-ylethyl)thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(2-oxo-2-thiophen-2-ylethyl)sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(2-thienyl)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C11H13N3O2S2 MolecularWeight: 283.36982

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=CC=CS2

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=CC=CS2

InChI

InChI=1S/C11H13N3O2S2/c1-2-5-14-10(16)12-13-11(14)18-7-8(15)9-4-3-6-17-9/h3-4,6H,2,5,7H2,1H3,(H,12,16)