tert-butyl N-[2-oxidanylidene-2-[4-[2-(1H-pyrazol-4-yl)ethyl]piperazin-1-yl]ethyl]-N-phenyl-carbamate

Systemtic Name: tert-butyl N-[2-oxidanylidene-2-[4-[2-(1H-pyrazol-4-yl)ethyl]piperazin-1-yl]ethyl]-N-phenyl-carbamate Openeye Name: tert-butyl N-[2-oxo-2-[4-[2-(1H-pyrazol-4-yl)ethyl]piperazin-1-yl]ethyl]-N-phenyl-carbamate CAS Name: N-[2-oxo-2-[4-[2-(1H-pyrazol-4-yl)ethyl]-1-piperazinyl]ethyl]-N-phenylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-oxo-2-[4-[2-(1H-pyrazol-4-yl)ethyl]piperazin-1-yl]ethyl]-N-phenylcarbamate Traditional Name: N-[2-keto-2-[4-[2-(1H-pyrazol-4-yl)ethyl]piperazino]ethyl]-N-phenyl-carbamic acid tert-butyl ester Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)CCC2=CNN=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)CCC2=CNN=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H31N5O3/c1-22(2,3)30-21(29)27(19-7-5-4-6-8-19)17-20(28)26-13-11-25(12-14-26)10-9-18-15-23-24-16-18/h4-8,15-16H,9-14,17H2,1-3H3,(H,23,24)