3-methyl-1-(2-methylpropyl)-5-propan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-methyl-1-(2-methylpropyl)-5-propan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-isobutyl-5-isopropylsulfanyl-3-methyl-6-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-methyl-1-(2-methylpropyl)-5-(propan-2-ylthio)-6-(3-pyridinylmethyl)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-1-(2-methylpropyl)-5-propan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-isobutyl-5-(isopropylthio)-3-methyl-6-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-2,4-quinone Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=C(S2)CC3=CN=CC=C3)SC(C)C)C(=O)N(C1=O)C

Isomeric SMILES

CC(C)CN1C2=C(C(=C(S2)CC3=CN=CC=C3)SC(C)C)C(=O)N(C1=O)C

InChI

InChI=1S/C20H25N3O2S2/c1-12(2)11-23-19-16(18(24)22(5)20(23)25)17(26-13(3)4)15(27-19)9-14-7-6-8-21-10-14/h6-8,10,12-13H,9,11H2,1-5H3