5-(1,3-benzothiazol-2-ylimino)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzothiazol-2-ylimino)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzothiazol-2-ylimino)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzothiazol-2-ylimino)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzothiazol-2-ylimino)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1,3-benzothiazol-2-ylimino)barbituric acid Formula: C11H6N4O3S MolecularWeight: 274.25534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N=C3C(=O)NC(=O)NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N=C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C11H6N4O3S/c16-8-7(9(17)15-10(18)14-8)13-11-12-5-3-1-2-4-6(5)19-11/h1-4H,(H2,14,15,16,17,18)