N-[3-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propylamino]-3-oxidanylidene-propyl]-2-methyl-benzamide

Systemtic Name: N-[3-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propylamino]-3-oxidanylidene-propyl]-2-methyl-benzamide Openeye Name: N-[3-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propylamino]-3-oxo-propyl]-2-methyl-benzamide CAS Name: N-[3-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propylamino]-3-oxopropyl]-2-methylbenzamide IUPAC Name: N-[3-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propylamino]-3-oxopropyl]-2-methylbenzamide Traditional Name: N-[3-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propylamino]-3-keto-propyl]-2-methyl-benzamide Formula: C24H25FN6O2 MolecularWeight: 448.492703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H25FN6O2/c1-16-5-2-3-6-19(16)24(33)29-14-12-22(32)28-13-4-7-21-20(15-26)23(27)31(30-21)18-10-8-17(25)9-11-18/h2-3,5-6,8-11H,4,7,12-14,27H2,1H3,(H,28,32)(H,29,33)