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

Systemtic Name: N-(4,5-dicyano-1H-imidazol-2-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(4,5-dicyano-1H-imidazol-2-yl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(4,5-dicyano-1H-imidazol-2-yl)-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(4,5-dicyano-1H-imidazol-2-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(4,5-dicyano-1H-imidazol-2-yl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C23H17N7O2S MolecularWeight: 455.49178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NC(=C(N3)C#N)C#N)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NC(=C(N3)C#N)C#N)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C23H17N7O2S/c24-12-17-18(13-25)28-23(27-17)29-21(32)19-14-33-22(26-19)16-8-10-30(11-9-16)20(31)7-6-15-4-2-1-3-5-15/h1-5,14,16H,8-11H2,(H2,27,28,29,32)