(5E)-1-hexyl-5-hydroxyimino-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-hexyl-5-hydroxyimino-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-hexyl-5-hydroxyimino-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-hexyl-5-hydroxyimino-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-hexyl-5-hydroxyimino-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-hexyl-5-hydroximino-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C10H15N3O3S MolecularWeight: 257.3094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=NO)C(=O)NC1=S

Isomeric SMILES

CCCCCCN1C(=O)/C(=N/O)/C(=O)NC1=S

InChI

InChI=1S/C10H15N3O3S/c1-2-3-4-5-6-13-9(15)7(12-16)8(14)11-10(13)17/h16H,2-6H2,1H3,(H,11,14,17)/b12-7+