3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-ethyl-pyrrolidine-2,5-dione

Systemtic Name: 3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-ethyl-pyrrolidine-2,5-dione Openeye Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-ethyl-pyrrolidine-2,5-dione CAS Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-ethylpyrrolidine-2,5-dione IUPAC Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-ethylpyrrolidine-2,5-dione Traditional Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-ethyl-pyrrolidine-2,5-quinone Formula: C8H11N5O2S MolecularWeight: 241.27024

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(C1=O)SC2=NNC(=N2)N

Isomeric SMILES

CCN1C(=O)CC(C1=O)SC2=NNC(=N2)N

InChI

InChI=1S/C8H11N5O2S/c1-2-13-5(14)3-4(6(13)15)16-8-10-7(9)11-12-8/h4H,2-3H2,1H3,(H3,9,10,11,12)