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

Systemtic Name: 3-methyl-7-propan-2-yl-1-propyl-5-(pyridin-3-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-isopropyl-3-methyl-1-propyl-5-(3-pyridylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 3-methyl-7-propan-2-yl-1-propyl-5-(3-pyridinylmethylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-7-propan-2-yl-1-propyl-5-(pyridin-3-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-isopropyl-3-methyl-1-propyl-5-(3-pyridylmethylthio)pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5O2S/c1-5-9-24-16-14(18(25)23(4)19(24)26)17(22-15(21-16)12(2)3)27-11-13-7-6-8-20-10-13/h6-8,10,12H,5,9,11H2,1-4H3