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

Systemtic Name: 1-cyclopropyl-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 1-cyclopropyl-7-[3-(2-thienyl)propyl]-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1-cyclopropyl-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1-cyclopropyl-5-sulfanylidene-7-(3-thiophen-2-ylpropyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1-cyclopropyl-7-[3-(2-thienyl)propyl]-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C(=O)NC2=O)C(=S)N=C(N3)CCCC4=CC=CS4

Isomeric SMILES

C1CC1N2C3=C(C(=O)NC2=O)C(=S)N=C(N3)CCCC4=CC=CS4

InChI

InChI=1S/C16H16N4O2S2/c21-14-12-13(20(9-6-7-9)16(22)19-14)17-11(18-15(12)23)5-1-3-10-4-2-8-24-10/h2,4,8-9H,1,3,5-7H2,(H,17,18,23)(H,19,21,22)