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

Systemtic Name: 2-[(4-ethanoylpiperazin-1-yl)methyl]-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-acetylpiperazin-1-yl)methyl]-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-acetyl-1-piperazinyl)methyl]-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-acetylpiperazin-1-yl)methyl]-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-acetylpiperazino)methyl]-5-(4-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N2

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N2

InChI

InChI=1S/C20H22N4O3S/c1-13(25)24-9-7-23(8-10-24)11-17-21-19(26)18-16(12-28-20(18)22-17)14-3-5-15(27-2)6-4-14/h3-6,12H,7-11H2,1-2H3,(H,21,22,26)