1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)-7-thiophen-2-yl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)-7-thiophen-2-yl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-5-(3-pyridylmethylsulfanyl)-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-5-(3-pyridinylmethylthio)-7-thiophen-2-ylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)-7-thiophen-2-ylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-5-(3-pyridylmethylthio)-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C18H15N5O2S2 MolecularWeight: 397.474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C3=CC=CS3)SCC4=CN=CC=C4)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C3=CC=CS3)SCC4=CN=CC=C4)C(=O)N(C1=O)C

InChI

InChI=1S/C18H15N5O2S2/c1-22-15-13(17(24)23(2)18(22)25)16(27-10-11-5-3-7-19-9-11)21-14(20-15)12-6-4-8-26-12/h3-9H,10H2,1-2H3