tert-butyl N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-N-phenyl-carbamate

Systemtic Name: tert-butyl N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-N-phenyl-carbamate Openeye Name: tert-butyl N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]piperazin-1-yl]-2-oxo-ethyl]-N-phenyl-carbamate CAS Name: N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]-1-piperazinyl]-2-oxoethyl]-N-phenylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]piperazin-1-yl]-2-oxoethyl]-N-phenylcarbamate Traditional Name: N-[2-[4-[2-(1H-imidazol-5-yl)ethyl]piperazino]-2-keto-ethyl]-N-phenyl-carbamic acid tert-butyl ester Formula: C22H31N5O3 MolecularWeight: 413.51324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)CCC2=CN=CN2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)N1CCN(CC1)CCC2=CN=CN2)C3=CC=CC=C3

InChI

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