(E)-1-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-chlorobenzoyl)piperazino]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one Formula: C28H24ClN5O2 MolecularWeight: 497.97546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H24ClN5O2/c29-24-11-8-21(9-12-24)28(36)33-17-15-32(16-18-33)26(35)13-10-23-20-34(25-6-2-1-3-7-25)31-27(23)22-5-4-14-30-19-22/h1-14,19-20H,15-18H2/b13-10+