4-[[5,5-dimethyl-4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]disulfanyl]butane-1-sulfinate

Systemtic Name: 4-[[5,5-dimethyl-4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]disulfanyl]butane-1-sulfinate Openeye Name: 4-[(5,5-dimethyl-4,6-dioxo-1H-pyrimidin-2-yl)disulfanyl]butane-1-sulfinate CAS Name: 4-[(5,5-dimethyl-4,6-dioxo-1H-pyrimidin-2-yl)disulfanyl]-1-butanesulfinate IUPAC Name: 4-[(5,5-dimethyl-4,6-dioxo-1H-pyrimidin-2-yl)disulfanyl]butane-1-sulfinate Traditional Name: 4-[(4,6-diketo-5,5-dimethyl-1H-pyrimidin-2-yl)disulfanyl]butane-1-sulfinate Formula: C10H15N2O4S3- MolecularWeight: 323.4321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC(=NC1=O)SSCCCCS(=O)[O-])C

Isomeric SMILES

CC1(C(=O)NC(=NC1=O)SSCCCCS(=O)[O-])C

InChI

InChI=1S/C10H16N2O4S3/c1-10(2)7(13)11-9(12-8(10)14)18-17-5-3-4-6-19(15)16/h3-6H2,1-2H3,(H,15,16)(H,11,12,13,14)/p-1