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

Systemtic Name: N-methyl-2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]-1,3-thiazole-5-carboxamide Openeye Name: N-methyl-2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]thiazole-5-carboxamide CAS Name: N-methyl-2-[4-(1-oxo-3-phenylprop-2-ynyl)-1-piperazinyl]-5-thiazolecarboxamide IUPAC Name: N-methyl-2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]-1,3-thiazole-5-carboxamide Traditional Name: N-methyl-2-[4-(3-phenylpropioloyl)piperazino]thiazole-5-carboxamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O2S/c1-19-17(24)15-13-20-18(25-15)22-11-9-21(10-12-22)16(23)8-7-14-5-3-2-4-6-14/h2-6,13H,9-12H2,1H3,(H,19,24)