N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C25H19FN4O2S MolecularWeight: 458.507363

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C25H19FN4O2S/c26-19-9-6-16(7-10-19)24-18(14-30(29-24)20-4-2-1-3-5-20)13-27-25(32)17-8-11-22-21(12-17)28-23(31)15-33-22/h1-12,14H,13,15H2,(H,27,32)(H,28,31)