3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(2-keto-2-p-phenetyl-ethyl)thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C15H19N3O3S/c1-3-9-18-14(20)16-17-15(18)22-10-13(19)11-5-7-12(8-6-11)21-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,16,20)