N-[4-(2-fluorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl]-2-(2-piperidin-1-ylethylamino)ethanamide

Systemtic Name: N-[4-(2-fluorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl]-2-(2-piperidin-1-ylethylamino)ethanamide Openeye Name: N-[4-(2-fluorobenzoyl)-2,5-dimethyl-pyrazol-3-yl]-2-[2-(1-piperidyl)ethylamino]acetamide CAS Name: N-[4-[(2-fluorophenyl)-oxomethyl]-2,5-dimethyl-3-pyrazolyl]-2-[2-(1-piperidinyl)ethylamino]acetamide IUPAC Name: N-[4-(2-fluorobenzoyl)-2,5-dimethylpyrazol-3-yl]-2-(2-piperidin-1-ylethylamino)acetamide Traditional Name: N-[4-(2-fluorobenzoyl)-2,5-dimethyl-pyrazol-3-yl]-2-(2-piperidinoethylamino)acetamide Formula: C21H28FN5O2 MolecularWeight: 401.477723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=CC=CC=C2F)NC(=O)CNCCN3CCCCC3)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=CC=CC=C2F)NC(=O)CNCCN3CCCCC3)C

InChI

InChI=1S/C21H28FN5O2/c1-15-19(20(29)16-8-4-5-9-17(16)22)21(26(2)25-15)24-18(28)14-23-10-13-27-11-6-3-7-12-27/h4-5,8-9,23H,3,6-7,10-14H2,1-2H3,(H,24,28)