(5S)-2-azanyl-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one

Systemtic Name: (5S)-2-azanyl-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one Openeye Name: (5S)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one CAS Name: (5S)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]-4-imidazolone IUPAC Name: (5S)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one Traditional Name: (5S)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-(4-nitrobenzyl)-2-imidazolin-4-one Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2(C(=O)N(C(=N2)N)CC3=CC=C(C=C3)[N+](=O)[O-])CC4CCCCC4

Isomeric SMILES

C1CCC(CC1)CC[C@@]2(C(=O)N(C(=N2)N)CC3=CC=C(C=C3)[N+](=O)[O-])CC4CCCCC4

InChI

InChI=1S/C25H36N4O3/c26-24-27-25(17-20-9-5-2-6-10-20,16-15-19-7-3-1-4-8-19)23(30)28(24)18-21-11-13-22(14-12-21)29(31)32/h11-14,19-20H,1-10,15-18H2,(H2,26,27)/t25-/m0/s1