3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one CAS Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-1-(4-phenyl-1-piperazinyl)-2-propen-1-one IUPAC Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one Traditional Name: 3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(4-phenylpiperazino)prop-2-en-1-one Formula: C30H30N4O3 MolecularWeight: 494.5842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C30H30N4O3/c1-36-27-15-13-23(21-28(27)37-2)30-24(22-34(31-30)26-11-7-4-8-12-26)14-16-29(35)33-19-17-32(18-20-33)25-9-5-3-6-10-25/h3-16,21-22H,17-20H2,1-2H3