2-[[4-[(E)-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]piperazin-1-yl]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-[(E)-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]piperazin-1-yl]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-[(E)-3-[5-(2-fluorophenyl)-2-furyl]prop-2-enoyl]piperazin-1-yl]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[(E)-3-[5-(2-fluorophenyl)-2-furanyl]-1-oxoprop-2-enyl]-1-piperazinyl]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[4-[(E)-3-[5-(2-fluorophenyl)furan-2-yl]prop-2-enoyl]piperazin-1-yl]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-[(E)-3-[5-(2-fluorophenyl)-2-furyl]acryloyl]piperazino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C26H25FN4O3S MolecularWeight: 492.565103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)C(=O)C=CC4=CC=C(O4)C5=CC=CC=C5F)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)C(=O)/C=C/C4=CC=C(O4)C5=CC=CC=C5F)C

InChI

InChI=1S/C26H25FN4O3S/c1-16-17(2)35-26-24(16)25(33)28-22(29-26)15-30-11-13-31(14-12-30)23(32)10-8-18-7-9-21(34-18)19-5-3-4-6-20(19)27/h3-10H,11-15H2,1-2H3,(H,28,29,33)/b10-8+