tert-butyl [3-cyclohexyl-6-(2-methylpropyl)-5-oxidanylidene-2-(1-phenylethylimino)-1,3-diazinan-1-yl] carbonate

Systemtic Name: tert-butyl [3-cyclohexyl-6-(2-methylpropyl)-5-oxidanylidene-2-(1-phenylethylimino)-1,3-diazinan-1-yl] carbonate Openeye Name: tert-butyl [3-cyclohexyl-6-isobutyl-5-oxo-2-(1-phenylethylimino)hexahydropyrimidin-1-yl] carbonate CAS Name: carbonic acid tert-butyl [3-cyclohexyl-6-(2-methylpropyl)-5-oxo-2-(1-phenylethylimino)-1,3-diazinan-1-yl] ester IUPAC Name: tert-butyl [3-cyclohexyl-6-(2-methylpropyl)-5-oxo-2-(1-phenylethylimino)-1,3-diazinan-1-yl] carbonate Traditional Name: carbonic acid tert-butyl [3-cyclohexyl-6-isobutyl-5-keto-2-(1-phenylethylimino)hexahydropyrimidin-1-yl] ester Formula: C27H41N3O4 MolecularWeight: 471.63214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)CN(C(=NC(C)C2=CC=CC=C2)N1OC(=O)OC(C)(C)C)C3CCCCC3

Isomeric SMILES

CC(C)CC1C(=O)CN(C(=NC(C)C2=CC=CC=C2)N1OC(=O)OC(C)(C)C)C3CCCCC3

InChI

InChI=1S/C27H41N3O4/c1-19(2)17-23-24(31)18-29(22-15-11-8-12-16-22)25(28-20(3)21-13-9-7-10-14-21)30(23)34-26(32)33-27(4,5)6/h7,9-10,13-14,19-20,22-23H,8,11-12,15-18H2,1-6H3