2-[3-[2-(butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-[2-(butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-[2-(butylamino)-2-oxo-ethyl]sulfanyl-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-[[2-(butylamino)-2-oxoethyl]thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-[2-(butylamino)-2-oxoethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-[[2-(butylamino)-2-keto-ethyl]thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide Formula: C14H19N5O2S2 MolecularWeight: 353.46296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1CC(=O)N)C2=CC=CS2

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1CC(=O)N)C2=CC=CS2

InChI

InChI=1S/C14H19N5O2S2/c1-2-3-6-16-12(21)9-23-14-18-17-13(10-5-4-7-22-10)19(14)8-11(15)20/h4-5,7H,2-3,6,8-9H2,1H3,(H2,15,20)(H,16,21)