N-(1H-indazol-6-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1H-indazol-6-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1H-indazol-6-yl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1H-indazol-6-yl)-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1H-indazol-6-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1H-indazol-6-yl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C25H21N5O2S MolecularWeight: 455.53154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=CC4=C(C=C3)C=NN4)C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=CC4=C(C=C3)C=NN4)C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C25H21N5O2S/c31-23(9-6-17-4-2-1-3-5-17)30-12-10-18(11-13-30)25-28-22(16-33-25)24(32)27-20-8-7-19-15-26-29-21(19)14-20/h1-5,7-8,14-16,18H,10-13H2,(H,26,29)(H,27,32)