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

Systemtic Name: 3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pentan-3-yl-pyrrolidine-2,5-dione Openeye Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1-ethylpropyl)pyrrolidine-2,5-dione CAS Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-pentan-3-ylpyrrolidine-2,5-dione IUPAC Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pentan-3-ylpyrrolidine-2,5-dione Traditional Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(1-ethylpropyl)pyrrolidine-2,5-quinone Formula: C11H17N5O2S MolecularWeight: 283.34998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)CC(C1=O)SC2=NNC(=N2)N

Isomeric SMILES

CCC(CC)N1C(=O)CC(C1=O)SC2=NNC(=N2)N

InChI

InChI=1S/C11H17N5O2S/c1-3-6(4-2)16-8(17)5-7(9(16)18)19-11-13-10(12)14-15-11/h6-7H,3-5H2,1-2H3,(H3,12,13,14,15)