2-[(4-ethanoylpiperazin-1-yl)methyl]-5-(2-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-ethanoylpiperazin-1-yl)methyl]-5-(2-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-acetylpiperazin-1-yl)methyl]-5-(o-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-acetyl-1-piperazinyl)methyl]-5-(2-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-acetylpiperazino)methyl]-5-(o-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CSC3=C2C(=O)NC(=N3)CN4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=CSC3=C2C(=O)NC(=N3)CN4CCN(CC4)C(=O)C

InChI

InChI=1S/C20H22N4O2S/c1-13-5-3-4-6-15(13)16-12-27-20-18(16)19(26)21-17(22-20)11-23-7-9-24(10-8-23)14(2)25/h3-6,12H,7-11H2,1-2H3,(H,21,22,26)