5-butan-2-yl-5-but-3-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-butan-2-yl-5-but-3-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-but-3-enyl-5-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-butan-2-yl-5-but-3-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-butan-2-yl-5-but-3-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-but-3-enyl-5-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H18N2O2S MolecularWeight: 254.34852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C(=O)NC(=S)NC1=O)CCC=C

Isomeric SMILES

CCC(C)C1(C(=O)NC(=S)NC1=O)CCC=C

InChI

InChI=1S/C12H18N2O2S/c1-4-6-7-12(8(3)5-2)9(15)13-11(17)14-10(12)16/h4,8H,1,5-7H2,2-3H3,(H2,13,14,15,16,17)