4-(4-methoxyphenyl)-2-sulfanylidene-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-dione

Systemtic Name: 4-(4-methoxyphenyl)-2-sulfanylidene-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-dione Openeye Name: 4-(4-methoxyphenyl)-2-thioxo-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-dione CAS Name: 4-(4-methoxyphenyl)-2-sulfanylidene-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-dione IUPAC Name: 4-(4-methoxyphenyl)-2-sulfanylidene-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-dione Traditional Name: 4-(4-methoxyphenyl)-2-thioxo-1,3,4,8-tetrahydropyrimido[4,5-d]pyrimidine-5,7-quinone Formula: C13H12N4O3S MolecularWeight: 304.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=C(NC(=O)NC3=O)NC(=S)N2

Isomeric SMILES

COC1=CC=C(C=C1)C2C3=C(NC(=O)NC3=O)NC(=S)N2

InChI

InChI=1S/C13H12N4O3S/c1-20-7-4-2-6(3-5-7)9-8-10(16-13(21)14-9)15-12(19)17-11(8)18/h2-5,9H,1H3,(H4,14,15,16,17,18,19,21)