3-methyl-5-[(4-phenylphenyl)methylsulfanyl]-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 3-methyl-5-[(4-phenylphenyl)methylsulfanyl]-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-isopropyl-3-methyl-5-[(4-phenylphenyl)methylsulfanyl]-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 3-methyl-5-[(4-phenylphenyl)methylthio]-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-5-[(4-phenylphenyl)methylsulfanyl]-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-isopropyl-3-methyl-5-[(4-phenylbenzyl)thio]-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)N(C1=O)C

InChI

InChI=1S/C26H28N4O2S/c1-5-15-30-23-21(25(31)29(4)26(30)32)24(28-22(27-23)17(2)3)33-16-18-11-13-20(14-12-18)19-9-7-6-8-10-19/h6-14,17H,5,15-16H2,1-4H3