1-(2-chlorophenyl)-3-[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(2-chlorophenyl)-3-[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(2-chlorophenyl)-3-[2-[1-(3-phenylprop-2-ynoyl)-4-piperidyl]pyrazol-3-yl]urea CAS Name: 1-(2-chlorophenyl)-3-[2-[1-(1-oxo-3-phenylprop-2-ynyl)-4-piperidinyl]-3-pyrazolyl]urea IUPAC Name: 1-(2-chlorophenyl)-3-[2-[1-(3-phenylprop-2-ynoyl)piperidin-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(2-chlorophenyl)-3-[2-[1-(3-phenylpropioloyl)-4-piperidyl]pyrazol-3-yl]urea Formula: C24H22ClN5O2 MolecularWeight: 447.91678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=CC=N2)NC(=O)NC3=CC=CC=C3Cl)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2C(=CC=N2)NC(=O)NC3=CC=CC=C3Cl)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H22ClN5O2/c25-20-8-4-5-9-21(20)27-24(32)28-22-12-15-26-30(22)19-13-16-29(17-14-19)23(31)11-10-18-6-2-1-3-7-18/h1-9,12,15,19H,13-14,16-17H2,(H2,27,28,32)