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

Systemtic Name: N-[(2R)-4-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1R)-3-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-1-methyl-3-oxo-propyl]benzamide CAS Name: N-[(2R)-4-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methylamino]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[(2R)-4-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylamino]-4-oxobutan-2-yl]benzamide Traditional Name: N-[(1R)-3-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-3-keto-1-methyl-propyl]benzamide Formula: C27H25FN4O2 MolecularWeight: 456.511403

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CC(=O)NCC1=CN(N=C1C2=CC=C(C=C2)F)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25FN4O2/c1-19(30-27(34)21-8-4-2-5-9-21)16-25(33)29-17-22-18-32(24-10-6-3-7-11-24)31-26(22)20-12-14-23(28)15-13-20/h2-15,18-19H,16-17H2,1H3,(H,29,33)(H,30,34)/t19-/m1/s1