5,6-dimethyl-2-[[4-(4-pyrazol-1-ylphenyl)carbonylpiperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[[4-(4-pyrazol-1-ylphenyl)carbonylpiperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[[4-(4-pyrazol-1-ylbenzoyl)piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[4-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-1-piperazinyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[[4-(4-pyrazol-1-ylbenzoyl)piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[[4-(4-pyrazol-1-ylbenzoyl)piperazino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H24N6O2S MolecularWeight: 448.54066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=CC=N5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=CC=N5)C

InChI

InChI=1S/C23H24N6O2S/c1-15-16(2)32-22-20(15)21(30)25-19(26-22)14-27-10-12-28(13-11-27)23(31)17-4-6-18(7-5-17)29-9-3-8-24-29/h3-9H,10-14H2,1-2H3,(H,25,26,30)