7-tert-butyl-3-methyl-1-propyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-tert-butyl-3-methyl-1-propyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-tert-butyl-3-methyl-1-propyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-tert-butyl-3-methyl-1-propyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-tert-butyl-3-methyl-1-propyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-tert-butyl-3-methyl-1-propyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C14H20N4O2S MolecularWeight: 308.3992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=S)N=C(N2)C(C)(C)C)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=S)N=C(N2)C(C)(C)C)C(=O)N(C1=O)C

InChI

InChI=1S/C14H20N4O2S/c1-6-7-18-9-8(11(19)17(5)13(18)20)10(21)16-12(15-9)14(2,3)4/h6-7H2,1-5H3,(H,15,16,21)