5-(furan-2-yl)-2-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(furan-2-yl)-2-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(2-furyl)-2-[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-furanyl)-2-[[[4-(2-methylpropyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(furan-2-yl)-2-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(2-furyl)-2-[[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N6O3S2 MolecularWeight: 472.58366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2)N5CCOCC5

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2)N5CCOCC5

InChI

InChI=1S/C21H24N6O3S2/c1-13(2)10-27-20(26-5-8-29-9-6-26)24-25-21(27)32-12-16-22-18(28)17-14(11-31-19(17)23-16)15-4-3-7-30-15/h3-4,7,11,13H,5-6,8-10,12H2,1-2H3,(H,22,23,28)