2-[methyl-[2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propyl-ethanamide

Systemtic Name: 2-[methyl-[2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propyl-ethanamide Openeye Name: 2-[methyl-[2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-propyl-acetamide CAS Name: 2-[methyl-[1-oxo-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]-N-propylacetamide IUPAC Name: 2-[methyl-[2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-propylacetamide Traditional Name: 2-[methyl-[2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-propyl-acetamide Formula: C15H20N6O2S MolecularWeight: 348.4233

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C(=O)CSC1=NNC(=N1)C2=CC=NC=C2

Isomeric SMILES

CCCNC(=O)CN(C)C(=O)CSC1=NNC(=N1)C2=CC=NC=C2

InChI

InChI=1S/C15H20N6O2S/c1-3-6-17-12(22)9-21(2)13(23)10-24-15-18-14(19-20-15)11-4-7-16-8-5-11/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,17,22)(H,18,19,20)