N-(2-ethylphenyl)-2-[2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[1-oxo-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]acetamide Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NCC(=O)NC2=CC=CC=C2CC)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NCC(=O)NC2=CC=CC=C2CC)C3=CC=NC=C3

InChI

InChI=1S/C22H26N6O2S/c1-3-13-28-21(17-9-11-23-12-10-17)26-27-22(28)31-15-20(30)24-14-19(29)25-18-8-6-5-7-16(18)4-2/h5-12H,3-4,13-15H2,1-2H3,(H,24,30)(H,25,29)