N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C22H19FN6O2S MolecularWeight: 450.488663

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN6O2S/c23-14-4-6-15(7-5-14)29-21(25)16(11-24)17(28-29)2-1-9-26-22(31)13-3-8-19-18(10-13)27-20(30)12-32-19/h3-8,10H,1-2,9,12,25H2,(H,26,31)(H,27,30)