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

Systemtic Name: but-2-ynyl N-[[3-(2-phenyl-4-piperidin-1-yl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]methyl]carbamate Openeye Name: but-2-ynyl N-[[3-[2-phenyl-4-(1-piperidyl)thiazol-5-yl]-1H-pyrazol-5-yl]methyl]carbamate CAS Name: N-[[3-[2-phenyl-4-(1-piperidinyl)-5-thiazolyl]-1H-pyrazol-5-yl]methyl]carbamic acid but-2-ynyl ester IUPAC Name: but-2-ynyl N-[[3-(2-phenyl-4-piperidin-1-yl-1,3-thiazol-5-yl)-1H-pyrazol-5-yl]methyl]carbamate Traditional Name: N-[[3-(2-phenyl-4-piperidino-thiazol-5-yl)-1H-pyrazol-5-yl]methyl]carbamic acid but-2-ynyl ester Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC(=O)NCC1=CC(=NN1)C2=C(N=C(S2)C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC#CCOC(=O)NCC1=CC(=NN1)C2=C(N=C(S2)C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C23H25N5O2S/c1-2-3-14-30-23(29)24-16-18-15-19(27-26-18)20-21(28-12-8-5-9-13-28)25-22(31-20)17-10-6-4-7-11-17/h4,6-7,10-11,15H,5,8-9,12-14,16H2,1H3,(H,24,29)(H,26,27)