N-(5-nitro-1H-indazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(5-nitro-1H-indazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(5-nitro-1H-indazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(5-nitro-1H-indazol-3-yl)-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(5-nitro-1H-indazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(5-nitro-1H-indazol-3-yl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C25H20N6O4S MolecularWeight: 500.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NNC4=C3C=C(C=C4)[N+](=O)[O-])C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NNC4=C3C=C(C=C4)[N+](=O)[O-])C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C25H20N6O4S/c32-22(9-6-16-4-2-1-3-5-16)30-12-10-17(11-13-30)25-26-21(15-36-25)24(33)27-23-19-14-18(31(34)35)7-8-20(19)28-29-23/h1-5,7-8,14-15,17H,10-13H2,(H2,27,28,29,33)