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

Systemtic Name: 1-[3-(3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)propyl]pyrrolidin-2-one Openeye Name: 1-[3-(3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)propyl]pyrrolidin-2-one CAS Name: 1-[3-[3-(methylthio)-5-phenyl-1,2,4-triazol-4-yl]propyl]-2-pyrrolidinone IUPAC Name: 1-[3-(3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)propyl]pyrrolidin-2-one Traditional Name: 1-[3-[3-(methylthio)-5-phenyl-1,2,4-triazol-4-yl]propyl]-2-pyrrolidone Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CCCN2CCCC2=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=NN=C(N1CCCN2CCCC2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS/c1-22-16-18-17-15(13-7-3-2-4-8-13)20(16)12-6-11-19-10-5-9-14(19)21/h2-4,7-8H,5-6,9-12H2,1H3