4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-2-oxo-ethyl]benzamide CAS Name: 4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methylamino]-2-oxoethyl]benzamide IUPAC Name: 4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylamino]-2-oxoethyl]benzamide Traditional Name: 4-ethoxy-N-[2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-2-keto-ethyl]benzamide Formula: C27H25FN4O3 MolecularWeight: 472.510803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C27H25FN4O3/c1-2-35-24-14-10-20(11-15-24)27(34)30-17-25(33)29-16-21-18-32(23-6-4-3-5-7-23)31-26(21)19-8-12-22(28)13-9-19/h3-15,18H,2,16-17H2,1H3,(H,29,33)(H,30,34)