7-cyclopentyl-5-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-cyclopentyl-5-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-cyclopentyl-5-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-cyclopentyl-5-[(2,5-dimethylphenyl)methylthio]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-cyclopentyl-5-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-cyclopentyl-5-[(2,5-dimethylbenzyl)thio]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4CCCC4

InChI

InChI=1S/C22H26N4O2S/c1-13-9-10-14(2)16(11-13)12-29-20-17-19(25(3)22(28)26(4)21(17)27)23-18(24-20)15-7-5-6-8-15/h9-11,15H,5-8,12H2,1-4H3