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

Systemtic Name: 1-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C17H20N4O2S/c1-2-4-15-18-17(20-19-15)24-11-14(22)12-6-8-13(9-7-12)21-10-3-5-16(21)23/h6-9H,2-5,10-11H2,1H3,(H,18,19,20)