5-[(5-chloranylthiophen-2-yl)methylsulfanyl]-1,7-dicyclopropyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 5-[(5-chloranylthiophen-2-yl)methylsulfanyl]-1,7-dicyclopropyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[(5-chloro-2-thienyl)methylsulfanyl]-1,7-dicyclopropyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-[(5-chloro-2-thiophenyl)methylthio]-1,7-dicyclopropylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-[(5-chlorothiophen-2-yl)methylsulfanyl]-1,7-dicyclopropylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[(5-chloro-2-thienyl)methylthio]-1,7-dicyclopropyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C17H15ClN4O2S2 MolecularWeight: 406.9096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(C(=O)NC(=O)N3C4CC4)C(=N2)SCC5=CC=C(S5)Cl

Isomeric SMILES

C1CC1C2=NC3=C(C(=O)NC(=O)N3C4CC4)C(=N2)SCC5=CC=C(S5)Cl

InChI

InChI=1S/C17H15ClN4O2S2/c18-11-6-5-10(26-11)7-25-16-12-14(19-13(20-16)8-1-2-8)22(9-3-4-9)17(24)21-15(12)23/h5-6,8-9H,1-4,7H2,(H,21,23,24)