6-ethyl-4-[4-(2-phenylethanoyl)piperazin-1-yl]-3H-thieno[2,3-d]pyrimidin-2-one

Systemtic Name: 6-ethyl-4-[4-(2-phenylethanoyl)piperazin-1-yl]-3H-thieno[2,3-d]pyrimidin-2-one Openeye Name: 6-ethyl-4-[4-(2-phenylacetyl)piperazin-1-yl]-3H-thieno[2,3-d]pyrimidin-2-one CAS Name: 6-ethyl-4-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]-3H-thieno[2,3-d]pyrimidin-2-one IUPAC Name: 6-ethyl-4-[4-(2-phenylacetyl)piperazin-1-yl]-3H-thieno[2,3-d]pyrimidin-2-one Traditional Name: 6-ethyl-4-[4-(2-phenylacetyl)piperazino]-3H-thieno[2,3-d]pyrimidin-2-one Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NC(=O)N=C2S1)N3CCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(NC(=O)N=C2S1)N3CCN(CC3)C(=O)CC4=CC=CC=C4

InChI

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