1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-ethyl-6-methyl-2-propan-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-ethyl-6-methyl-2-propan-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-ethyl-2-isopropyl-6-methyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-ethyl-6-methyl-2-propan-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-ethyl-6-methyl-2-propan-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-ethyl-2-isopropyl-6-methyl-thieno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=NC(=N2)C(C)C)SCC(=O)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=NC(=N2)C(C)C)SCC(=O)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C22H24N2O3S2/c1-5-15-13(4)29-22-19(15)21(23-20(24-22)12(2)3)28-11-16(25)14-6-7-17-18(10-14)27-9-8-26-17/h6-7,10,12H,5,8-9,11H2,1-4H3