5-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(E)-3-phenylprop-2-enoyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(E)-1-oxo-3-phenylprop-2-enyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(E)-3-phenylacryloyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H10N2O3S MolecularWeight: 274.2951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O3S/c16-9(7-6-8-4-2-1-3-5-8)10-11(17)14-13(19)15-12(10)18/h1-7,10H,(H2,14,15,17,18,19)/b7-6+