ethyl 4-(N,N'-dicyclohexylcarbamimidoyl)selanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: ethyl 4-(N,N'-dicyclohexylcarbamimidoyl)selanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-4-(N,N'-dicyclohexylcarbamimidoyl)selanyl-butanoate CAS Name: 4-[[(cyclohexylamino)-cyclohexyliminomethyl]seleno]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-(N,N'-dicyclohexylcarbamimidoyl)selanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-[(N,N'-dicyclohexylamidino)seleno]butyric acid ethyl ester Formula: C24H43N3O4Se MolecularWeight: 512.538444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC[Se]C(=NC1CCCCC1)NC2CCCCC2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC[75Se]C(=NC1CCCCC1)NC2CCCCC2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H43N3O4Se/c1-5-30-21(28)20(27-23(29)31-24(2,3)4)16-17-32-22(25-18-12-8-6-9-13-18)26-19-14-10-7-11-15-19/h18-20H,5-17H2,1-4H3,(H,25,26)(H,27,29)/i32-4