(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-phenyl-5-(2-thienyl)pyrazol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (2-phenyl-5-thiophen-2-yl-3-pyrazolyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-phenyl-5-(2-thienyl)pyrazol-3-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C22H20N6OS MolecularWeight: 416.4988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C22H20N6OS/c29-21(26-11-13-27(14-12-26)22-23-9-5-10-24-22)19-16-18(20-8-4-15-30-20)25-28(19)17-6-2-1-3-7-17/h1-10,15-16H,11-14H2