N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]propanamide CAS Name: N-[4-[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)NC(=O)CC

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)NC(=O)CC

InChI

InChI=1S/C16H20N4O2S/c1-3-5-14-18-16(20-19-14)23-10-13(21)11-6-8-12(9-7-11)17-15(22)4-2/h6-9H,3-5,10H2,1-2H3,(H,17,22)(H,18,19,20)