2-[2-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]sulfanylethanamide

Systemtic Name: 2-[2-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]sulfanylethanamide Openeye Name: 2-[2-[[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]sulfanylacetamide CAS Name: 2-[[2-[[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]thio]acetamide IUPAC Name: 2-[2-[[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[[2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]phenyl]thio]acetamide Formula: C16H21N5O3S2 MolecularWeight: 395.49964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC=CC=C2SCC(=O)N

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC=CC=C2SCC(=O)N

InChI

InChI=1S/C16H21N5O3S2/c1-2-3-8-21-15(24)19-20-16(21)26-10-14(23)18-11-6-4-5-7-12(11)25-9-13(17)22/h4-7H,2-3,8-10H2,1H3,(H2,17,22)(H,18,23)(H,19,24)