but-2-ynyl N-[1-[3-(4-piperidin-1-yl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]propyl]carbamate

Systemtic Name: but-2-ynyl N-[1-[3-(4-piperidin-1-yl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]propyl]carbamate Openeye Name: but-2-ynyl N-[1-[3-[4-(1-piperidyl)-2-(3-pyridyl)thiazol-5-yl]-1H-pyrazol-5-yl]propyl]carbamate CAS Name: N-[1-[3-[4-(1-piperidinyl)-2-(3-pyridinyl)-5-thiazolyl]-1H-pyrazol-5-yl]propyl]carbamic acid but-2-ynyl ester IUPAC Name: but-2-ynyl N-[1-[3-(4-piperidin-1-yl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]propyl]carbamate Traditional Name: N-[1-[3-[4-piperidino-2-(3-pyridyl)thiazol-5-yl]-1H-pyrazol-5-yl]propyl]carbamic acid but-2-ynyl ester Formula: C24H28N6O2S MolecularWeight: 464.58312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=NN1)C2=C(N=C(S2)C3=CN=CC=C3)N4CCCCC4)NC(=O)OCC#CC

Isomeric SMILES

CCC(C1=CC(=NN1)C2=C(N=C(S2)C3=CN=CC=C3)N4CCCCC4)NC(=O)OCC#CC

InChI

InChI=1S/C24H28N6O2S/c1-3-5-14-32-24(31)26-18(4-2)19-15-20(29-28-19)21-22(30-12-7-6-8-13-30)27-23(33-21)17-10-9-11-25-16-17/h9-11,15-16,18H,4,6-8,12-14H2,1-2H3,(H,26,31)(H,28,29)