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

Systemtic Name: 5-bromanyl-3-methyl-1-(2-methylpropyl)-6-pyridin-3-ylcarbonyl-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 5-bromo-1-isobutyl-3-methyl-6-(pyridine-3-carbonyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 5-bromo-3-methyl-1-(2-methylpropyl)-6-[oxo(3-pyridinyl)methyl]thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 5-bromo-3-methyl-1-(2-methylpropyl)-6-(pyridine-3-carbonyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-bromo-1-isobutyl-3-methyl-6-nicotinoyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O3S/c1-9(2)8-21-16-11(15(23)20(3)17(21)24)12(18)14(25-16)13(22)10-5-4-6-19-7-10/h4-7,9H,8H2,1-3H3