N-[3-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-3-oxidanylidene-propyl]-3-methyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

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