tert-butyl 3-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylimino-6-(2-methylpropyl)-5-oxidanylidene-1,3-diazinane-1-carboxylate

Systemtic Name: tert-butyl 3-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylimino-6-(2-methylpropyl)-5-oxidanylidene-1,3-diazinane-1-carboxylate Openeye Name: tert-butyl 3-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylimino-6-isobutyl-5-oxo-hexahydropyrimidine-1-carboxylate CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2-cyclohexylimino-6-(2-methylpropyl)-5-oxo-1,3-diazinane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylimino-6-(2-methylpropyl)-5-oxo-1,3-diazinane-1-carboxylate Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylimino-6-isobutyl-5-keto-hexahydropyrimidine-1-carboxylic acid tert-butyl ester Formula: C27H45N3O3 MolecularWeight: 459.6645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)CN(C(=NC2CCCCC2)N1C(=O)OC(C)(C)C)CCC3=CCCCC3

Isomeric SMILES

CC(C)CC1C(=O)CN(C(=NC2CCCCC2)N1C(=O)OC(C)(C)C)CCC3=CCCCC3

InChI

InChI=1S/C27H45N3O3/c1-20(2)18-23-24(31)19-29(17-16-21-12-8-6-9-13-21)25(28-22-14-10-7-11-15-22)30(23)26(32)33-27(3,4)5/h12,20,22-23H,6-11,13-19H2,1-5H3