5-(3-methylsulfonyl-1H-1,2,4-triazol-5-yl)-1-(phenylmethyl)pyrrolidin-2-one

Systemtic Name: 5-(3-methylsulfonyl-1H-1,2,4-triazol-5-yl)-1-(phenylmethyl)pyrrolidin-2-one Openeye Name: 1-benzyl-5-(3-methylsulfonyl-1H-1,2,4-triazol-5-yl)pyrrolidin-2-one CAS Name: 5-(3-methylsulfonyl-1H-1,2,4-triazol-5-yl)-1-(phenylmethyl)-2-pyrrolidinone IUPAC Name: 1-benzyl-5-(3-methylsulfonyl-1H-1,2,4-triazol-5-yl)pyrrolidin-2-one Traditional Name: 1-benzyl-5-(3-mesyl-1H-1,2,4-triazol-5-yl)-2-pyrrolidone Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NNC(=N1)C2CCC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=NNC(=N1)C2CCC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C14H16N4O3S/c1-22(20,21)14-15-13(16-17-14)11-7-8-12(19)18(11)9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,16,17)