(5S)-5-butyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-5-butyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-5-butyl-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-butyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-butyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-5-butyl-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H16N2O2S MolecularWeight: 276.35404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCC[C@H]1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O2S/c1-2-3-9-11-12(17)15-14(19)16(13(11)18)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3,(H,15,17,19)/t11-/m0/s1