(E)-3-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-[3-(2-methoxyphenyl)-1-phenyl-4-pyrazolyl]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-[3-(2-methoxyphenyl)-1-phenylpyrazol-4-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C=CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2/C=C/C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O3S/c1-35-24-11-6-5-10-23(24)27-21(20-32(29-27)22-8-3-2-4-9-22)13-14-26(33)30-15-17-31(18-16-30)28(34)25-12-7-19-36-25/h2-14,19-20H,15-18H2,1H3/b14-13+