tert-butyl 6-(2-methylpropyl)-5-oxidanylidene-2-(1-phenylethylimino)-3-(3-phenylpropyl)-1,3-diazinane-1-carboxylate

Systemtic Name: tert-butyl 6-(2-methylpropyl)-5-oxidanylidene-2-(1-phenylethylimino)-3-(3-phenylpropyl)-1,3-diazinane-1-carboxylate Openeye Name: tert-butyl 6-isobutyl-5-oxo-2-(1-phenylethylimino)-3-(3-phenylpropyl)hexahydropyrimidine-1-carboxylate CAS Name: 6-(2-methylpropyl)-5-oxo-2-(1-phenylethylimino)-3-(3-phenylpropyl)-1,3-diazinane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(2-methylpropyl)-5-oxo-2-(1-phenylethylimino)-3-(3-phenylpropyl)-1,3-diazinane-1-carboxylate Traditional Name: 6-isobutyl-5-keto-2-(1-phenylethylimino)-3-(3-phenylpropyl)hexahydropyrimidine-1-carboxylic acid tert-butyl ester Formula: C30H41N3O3 MolecularWeight: 491.66484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)CN(C(=NC(C)C2=CC=CC=C2)N1C(=O)OC(C)(C)C)CCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1C(=O)CN(C(=NC(C)C2=CC=CC=C2)N1C(=O)OC(C)(C)C)CCCC3=CC=CC=C3

InChI

InChI=1S/C30H41N3O3/c1-22(2)20-26-27(34)21-32(19-13-16-24-14-9-7-10-15-24)28(33(26)29(35)36-30(4,5)6)31-23(3)25-17-11-8-12-18-25/h7-12,14-15,17-18,22-23,26H,13,16,19-21H2,1-6H3