6,7-dimethyl-3-[2-methyl-2,3-bis(sulfanyl)propyl]-1H-pteridine-2,4-dione

Systemtic Name: 6,7-dimethyl-3-[2-methyl-2,3-bis(sulfanyl)propyl]-1H-pteridine-2,4-dione Openeye Name: 6,7-dimethyl-3-[2-methyl-2,3-bis(sulfanyl)propyl]-1H-pteridine-2,4-dione CAS Name: 3-(2,3-dimercapto-2-methylpropyl)-6,7-dimethyl-1H-pteridine-2,4-dione IUPAC Name: 6,7-dimethyl-3-[2-methyl-2,3-bis(sulfanyl)propyl]-1H-pteridine-2,4-dione Traditional Name: 3-(2,3-dimercapto-2-methyl-propyl)-6,7-dimethyl-1H-pteridine-2,4-quinone Formula: C12H16N4O2S2 MolecularWeight: 312.41104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(NC(=O)N(C2=O)CC(C)(CS)S)N=C1C

Isomeric SMILES

CC1=NC2=C(NC(=O)N(C2=O)CC(C)(CS)S)N=C1C

InChI

InChI=1S/C12H16N4O2S2/c1-6-7(2)14-9-8(13-6)10(17)16(11(18)15-9)4-12(3,20)5-19/h19-20H,4-5H2,1-3H3,(H,14,15,18)