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

Systemtic Name: 3-methyl-1-(2-methylpropyl)-5-(3-oxidanylpyrrolidin-1-yl)sulfonyl-6-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 5-(3-hydroxypyrrolidin-1-yl)sulfonyl-1-isobutyl-3-methyl-6-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 5-[(3-hydroxy-1-pyrrolidinyl)sulfonyl]-3-methyl-1-(2-methylpropyl)-6-(3-pyridinylmethyl)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 5-(3-hydroxypyrrolidin-1-yl)sulfonyl-3-methyl-1-(2-methylpropyl)-6-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-(3-hydroxypyrrolidino)sulfonyl-1-isobutyl-3-methyl-6-(3-pyridylmethyl)thieno[2,3-d]pyrimidine-2,4-quinone Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=C(S2)CC3=CN=CC=C3)S(=O)(=O)N4CCC(C4)O)C(=O)N(C1=O)C

Isomeric SMILES

CC(C)CN1C2=C(C(=C(S2)CC3=CN=CC=C3)S(=O)(=O)N4CCC(C4)O)C(=O)N(C1=O)C

InChI

InChI=1S/C21H26N4O5S2/c1-13(2)11-25-20-17(19(27)23(3)21(25)28)18(32(29,30)24-8-6-15(26)12-24)16(31-20)9-14-5-4-7-22-10-14/h4-5,7,10,13,15,26H,6,8-9,11-12H2,1-3H3