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

Systemtic Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[[4-(2,3-dimethylphenyl)piperazino]methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCN(CC3)C4=CC=CC(=C4C)C

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C21H26N4OS/c1-4-17-12-18-20(27-17)22-13-25(21(18)26)14-23-8-10-24(11-9-23)19-7-5-6-15(2)16(19)3/h5-7,12-13H,4,8-11,14H2,1-3H3