(E)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-1-(4-phenyl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-1-(4-phenylpiperazino)prop-2-en-1-one Formula: C24H25ClN4O MolecularWeight: 420.9345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCN(CC2)C3=CC=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)N2CCN(CC2)C3=CC=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H25ClN4O/c1-19-22(24(25)29(26-19)18-20-8-4-2-5-9-20)12-13-23(30)28-16-14-27(15-17-28)21-10-6-3-7-11-21/h2-13H,14-18H2,1H3/b13-12+