1-(2-methoxyethyl)-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 1-(2-methoxyethyl)-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 1-(2-methoxyethyl)-7-[3-(2-thienyl)propyl]-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1-(2-methoxyethyl)-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1-(2-methoxyethyl)-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1-(2-methoxyethyl)-7-[3-(2-thienyl)propyl]-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C16H18N4O3S2 MolecularWeight: 378.46912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)CCCC3=CC=CS3

Isomeric SMILES

COCCN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)CCCC3=CC=CS3

InChI

InChI=1S/C16H18N4O3S2/c1-23-8-7-20-13-12(14(21)19-16(20)22)15(24)18-11(17-13)6-2-4-10-5-3-9-25-10/h3,5,9H,2,4,6-8H2,1H3,(H,17,18,24)(H,19,21,22)