N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-(propan-2-ylcarbamoylamino)benzamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-(propan-2-ylcarbamoylamino)benzamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-(isopropylcarbamoylamino)benzamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-3-[[oxo-(propan-2-ylamino)methyl]amino]benzamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-(propan-2-ylcarbamoylamino)benzamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-(isopropylcarbamoylamino)benzamide Formula: C24H26FN7O2 MolecularWeight: 463.507343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H26FN7O2/c1-15(2)29-24(34)30-18-6-3-5-16(13-18)23(33)28-12-4-7-21-20(14-26)22(27)32(31-21)19-10-8-17(25)9-11-19/h3,5-6,8-11,13,15H,4,7,12,27H2,1-2H3,(H,28,33)(H2,29,30,34)