N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C18H21ClFN5O2 MolecularWeight: 393.843043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2CCN(CC2)CC(=O)N)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2CCN(CC2)CC(=O)N)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H21ClFN5O2/c1-11-16(17(19)25(23-11)14-4-2-12(20)3-5-14)18(27)22-13-6-8-24(9-7-13)10-15(21)26/h2-5,13H,6-10H2,1H3,(H2,21,26)(H,22,27)