(8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (8-tert-butyl-4-oxa-3-azaspiro[4.5]dec-2-en-2-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2(CC1)CC(=NO2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)(C)C1CCC2(CC1)CC(=NO2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H31N5O2/c1-20(2,3)16-5-7-21(8-6-16)15-17(24-28-21)18(27)25-11-13-26(14-12-25)19-22-9-4-10-23-19/h4,9-10,16H,5-8,11-15H2,1-3H3