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

Systemtic Name: 2-[[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-1-yl]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[[4-(1-pyrazolyl)phenyl]methyl]-1-piperazinyl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(4-pyrazol-1-ylbenzyl)piperazino]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H24N6OS2 MolecularWeight: 488.62766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)CC4=NC5=C(C(=CS5)C6=CC=CS6)C(=O)N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)CC4=NC5=C(C(=CS5)C6=CC=CS6)C(=O)N4

InChI

InChI=1S/C25H24N6OS2/c32-24-23-20(21-3-1-14-33-21)17-34-25(23)28-22(27-24)16-30-12-10-29(11-13-30)15-18-4-6-19(7-5-18)31-9-2-8-26-31/h1-9,14,17H,10-13,15-16H2,(H,27,28,32)