2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C21H24N4O2S/c1-21(2,15-6-4-3-5-7-15)20(27)25-11-9-24(10-12-25)14-17-22-16-8-13-28-18(16)19(26)23-17/h3-8,13H,9-12,14H2,1-2H3,(H,22,23,26)