3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: 3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: 3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: 3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C24H22N6OS MolecularWeight: 442.53608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C24H22N6OS/c31-22(28-13-15-29(16-14-28)24-25-11-5-12-26-24)10-9-19-18-30(20-6-2-1-3-7-20)27-23(19)21-8-4-17-32-21/h1-12,17-18H,13-16H2