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

Systemtic Name: 3-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(2-ketopyrrolidino)ethyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C(=O)CSC2=NNC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C1)C(=O)CSC2=NNC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C16H18N4O3S/c21-13-7-4-9-19(13)14(22)11-24-16-18-17-15(23)20(16)10-8-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H,17,23)