N-[(5S)-2-tert-butyl-5-oxidanylidene-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[(5S)-2-tert-butyl-5-oxidanylidene-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluoranyl-benzamide Openeye Name: N-[(5S)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluoro-benzamide CAS Name: N-[(5S)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluorobenzamide IUPAC Name: N-[(5S)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluorobenzamide Traditional Name: N-[(5S)-2-tert-butyl-5-keto-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-fluoro-benzamide Formula: C16H18FN3O2S MolecularWeight: 335.396423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C2CS(=O)CC2=N1)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)N1C(=C2C[S@](=O)CC2=N1)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C16H18FN3O2S/c1-16(2,3)20-14(11-8-23(22)9-13(11)19-20)18-15(21)10-6-4-5-7-12(10)17/h4-7H,8-9H2,1-3H3,(H,18,21)/t23-/m0/s1