N-[2-(1-but-2-ynoylpiperidin-4-yl)pyrazol-3-yl]-3-phenyl-propanamide

Systemtic Name: N-[2-(1-but-2-ynoylpiperidin-4-yl)pyrazol-3-yl]-3-phenyl-propanamide Openeye Name: N-[2-(1-but-2-ynoyl-4-piperidyl)pyrazol-3-yl]-3-phenyl-propanamide CAS Name: N-[2-[1-(1-oxobut-2-ynyl)-4-piperidinyl]-3-pyrazolyl]-3-phenylpropanamide IUPAC Name: N-[2-(1-but-2-ynoylpiperidin-4-yl)pyrazol-3-yl]-3-phenylpropanamide Traditional Name: N-[2-(1-but-2-ynoyl-4-piperidyl)pyrazol-3-yl]-3-phenyl-propionamide Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC#CC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2/c1-2-6-21(27)24-15-12-18(13-16-24)25-19(11-14-22-25)23-20(26)10-9-17-7-4-3-5-8-17/h3-5,7-8,11,14,18H,9-10,12-13,15-16H2,1H3,(H,23,26)