3-[2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)phenyl]ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-[3-(2-ketopyrrolidino)phenyl]ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=CC(=CC=C2)N3CCCC3=O

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C17H20N4O3S/c1-2-8-21-16(24)18-19-17(21)25-11-14(22)12-5-3-6-13(10-12)20-9-4-7-15(20)23/h3,5-6,10H,2,4,7-9,11H2,1H3,(H,18,24)