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

Systemtic Name: 3-methyl-1-(2-methylpropyl)-6-pyridin-3-ylcarbonyl-5-thiophen-2-ylsulfanyl-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-isobutyl-3-methyl-6-(pyridine-3-carbonyl)-5-(2-thienylsulfanyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-methyl-1-(2-methylpropyl)-6-[oxo(3-pyridinyl)methyl]-5-(thiophen-2-ylthio)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-1-(2-methylpropyl)-6-(pyridine-3-carbonyl)-5-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-isobutyl-3-methyl-6-nicotinoyl-5-(2-thienylthio)thieno[2,3-d]pyrimidine-2,4-quinone Formula: C21H19N3O3S3 MolecularWeight: 457.58886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=C(S2)C(=O)C3=CN=CC=C3)SC4=CC=CS4)C(=O)N(C1=O)C

Isomeric SMILES

CC(C)CN1C2=C(C(=C(S2)C(=O)C3=CN=CC=C3)SC4=CC=CS4)C(=O)N(C1=O)C

InChI

InChI=1S/C21H19N3O3S3/c1-12(2)11-24-20-15(19(26)23(3)21(24)27)17(29-14-7-5-9-28-14)18(30-20)16(25)13-6-4-8-22-10-13/h4-10,12H,11H2,1-3H3