2-[4-[2-[[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[2-[[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[2-oxo-2-[[2-phenyl-5-(p-tolyl)pyrazol-3-yl]amino]ethyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[2-[[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-1-piperazinyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[2-[[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]amino]-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[2-keto-2-[[2-phenyl-5-(p-tolyl)pyrazol-3-yl]amino]ethyl]piperazino]acetamide Formula: C27H32N6O2 MolecularWeight: 472.58198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CN3CCN(CC3)CC(=O)NCC=C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CN3CCN(CC3)CC(=O)NCC=C)C4=CC=CC=C4

InChI

InChI=1S/C27H32N6O2/c1-3-13-28-26(34)19-31-14-16-32(17-15-31)20-27(35)29-25-18-24(22-11-9-21(2)10-12-22)30-33(25)23-7-5-4-6-8-23/h3-12,18H,1,13-17,19-20H2,2H3,(H,28,34)(H,29,35)