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

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(2,5-dimethylpyrazol-3-yl)-2-[1-(3-phenylpropioloyl)-4-piperidyl]thiazole-4-carboxamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4)C

InChI

InChI=1S/C23H23N5O2S/c1-16-14-20(27(2)26-16)25-22(30)19-15-31-23(24-19)18-10-12-28(13-11-18)21(29)9-8-17-6-4-3-5-7-17/h3-7,14-15,18H,10-13H2,1-2H3,(H,25,30)