4-(acetamidomethyl)-N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]benzamide

Systemtic Name: 4-(acetamidomethyl)-N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]benzamide Openeye Name: 4-(acetamidomethyl)-N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]benzamide CAS Name: 4-(acetamidomethyl)-N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]benzamide IUPAC Name: 4-(acetamidomethyl)-N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]benzamide Traditional Name: 4-(acetamidomethyl)-N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]benzamide Formula: C23H23FN6O2 MolecularWeight: 434.466123

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H23FN6O2/c1-15(31)28-14-16-4-6-17(7-5-16)23(32)27-12-2-3-21-20(13-25)22(26)30(29-21)19-10-8-18(24)9-11-19/h4-11H,2-3,12,14,26H2,1H3,(H,27,32)(H,28,31)