5-(5-methylthiophen-2-yl)-2-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(5-methylthiophen-2-yl)-2-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(5-methyl-2-thienyl)-2-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(5-methyl-2-thiophenyl)-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(5-methylthiophen-2-yl)-2-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(5-methyl-2-thienyl)-2-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20F3N5OS2 MolecularWeight: 491.55231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CN4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)CN4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C22H20F3N5OS2/c1-13-2-4-16(33-13)15-12-32-21-19(15)20(31)27-17(28-21)11-29-6-8-30(9-7-29)18-5-3-14(10-26-18)22(23,24)25/h2-5,10,12H,6-9,11H2,1H3,(H,27,28,31)