N-[(2S)-butan-2-yl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[(1S)-1-methylpropyl]-1H-pyrazole-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-[(2S)-butan-2-yl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-[(1S)-1-methylpropyl]-1H-pyrazole-4-carboxamide Formula: C14H16FN3O MolecularWeight: 261.294743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(NN=C1)C2=CC=C(C=C2)F

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C(NN=C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H16FN3O/c1-3-9(2)17-14(19)12-8-16-18-13(12)10-4-6-11(15)7-5-10/h4-9H,3H2,1-2H3,(H,16,18)(H,17,19)/t9-/m0/s1