5-[1,4-bis(oxidanylidene)-1,4-diphenyl-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1,4-bis(oxidanylidene)-1,4-diphenyl-butan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(1-benzoyl-3-oxo-3-phenyl-propyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(1,4-dioxo-1,4-diphenylbutan-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(1,4-dioxo-1,4-diphenylbutan-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(1-benzoyl-3-keto-3-phenyl-propyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H16N2O4S MolecularWeight: 380.41704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(C2C(=O)NC(=S)NC2=O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(C2C(=O)NC(=S)NC2=O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H16N2O4S/c23-15(12-7-3-1-4-8-12)11-14(17(24)13-9-5-2-6-10-13)16-18(25)21-20(27)22-19(16)26/h1-10,14,16H,11H2,(H2,21,22,25,26,27)