ethyl 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]thiazole-5-carboxylate CAS Name: 2-[4-(1-oxo-3-phenylprop-2-ynyl)-1-piperazinyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]-1,3-thiazole-5-carboxylate Traditional Name: 2-[4-(3-phenylpropioloyl)piperazino]thiazole-5-carboxylic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(S1)N2CCN(CC2)C(=O)C#CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(S1)N2CCN(CC2)C(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O3S/c1-2-25-18(24)16-14-20-19(26-16)22-12-10-21(11-13-22)17(23)9-8-15-6-4-3-5-7-15/h3-7,14H,2,10-13H2,1H3