5-(2-nitro-1-thiophen-2-yl-ethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(2-nitro-1-thiophen-2-yl-ethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[2-nitro-1-(2-thienyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-(2-nitro-1-thiophen-2-ylethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(2-nitro-1-thiophen-2-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[2-nitro-1-(2-thienyl)ethyl]barbituric acid Formula: C10H9N3O5S MolecularWeight: 283.26056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(C[N+](=O)[O-])C2C(=O)NC(=O)NC2=O

Isomeric SMILES

C1=CSC(=C1)C(C[N+](=O)[O-])C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C10H9N3O5S/c14-8-7(9(15)12-10(16)11-8)5(4-13(17)18)6-2-1-3-19-6/h1-3,5,7H,4H2,(H2,11,12,14,15,16)