(2S)-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propan-1-one

Systemtic Name: (2S)-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propan-1-one Openeye Name: (2S)-1-[4-(furan-2-carbonyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propan-1-one CAS Name: (2S)-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-(4-thieno[2,3-d]pyrimidinylthio)-1-propanone IUPAC Name: (2S)-1-[4-(furan-2-carbonyl)piperazin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropan-1-one Traditional Name: (2S)-1-[4-(2-furoyl)piperazino]-2-(thieno[2,3-d]pyrimidin-4-ylthio)propan-1-one Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)SC3=NC=NC4=C3C=CS4

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)SC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C18H18N4O3S2/c1-12(27-16-13-4-10-26-15(13)19-11-20-16)17(23)21-5-7-22(8-6-21)18(24)14-3-2-9-25-14/h2-4,9-12H,5-8H2,1H3/t12-/m0/s1