5-(2-nitrophenyl)sulfanyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(2-nitrophenyl)sulfanyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(2-nitrophenyl)sulfanylhexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-nitrophenyl)thio]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(2-nitrophenyl)sulfanyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(2-nitrophenyl)thio]barbituric acid Formula: C10H7N3O5S MolecularWeight: 281.24468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])SC2C(=O)NC(=O)NC2=O

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])SC2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C10H7N3O5S/c14-8-7(9(15)12-10(16)11-8)19-6-4-2-1-3-5(6)13(17)18/h1-4,7H,(H2,11,12,14,15,16)