7-ethyl-1,3-dimethyl-5-[(Z)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-ethyl-1,3-dimethyl-5-[(Z)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[(Z)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanyl-7-ethyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-ethyl-5-[[(Z)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-ethyl-5-[(Z)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[[(Z)-1-acetyl-2-hydroxy-prop-1-enyl]thio]-7-ethyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C15H18N4O4S MolecularWeight: 350.39282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)SC(=C(C)O)C(=O)C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCC1=NC2=C(C(=N1)S/C(=C(/C)\O)/C(=O)C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C15H18N4O4S/c1-6-9-16-12-10(14(22)19(5)15(23)18(12)4)13(17-9)24-11(7(2)20)8(3)21/h20H,6H2,1-5H3/b11-7-