YOD
(1R,3S,5S,7S)-N-[(1r,4R)-4-aminocyclohexyl]-3-[(methylsulfanyl)methyl]-5-phenyladamantane-1-carboxamide
Find entries where: YOD
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | (1R,3S,5S,7S)-N-[(1r,4R)-4-aminocyclohexyl]-3-[(methylsulfanyl)methyl]-5-phenyladamantane-1-carboxamide |
Identifiers | (1~{R},3~{S},5~{S},7~{S})-~{N}-(4-azanylcyclohexyl)-3-(methylsulfanylmethyl)-5-phenyl-adamantane-1-carboxamide |
Formula | C25 H36 N2 O S |
Molecular Weight | 412.631 |
Type | NON-POLYMER |
Isomeric SMILES | CSC[C@@]12C[C@H]3C[C@@](C1)(C[C@](C3)(C2)C(=O)NC4CCC(CC4)N)c5ccccc5 |
InChI | InChI=1S/C25H36N2OS/c1-29-17-23-11-18-12-24(14-23,19-5-3-2-4-6-19)16-25(13-18,15-23)22(28)27-21-9-7-20(26)8-10-21/h2-6,18,20-21H,7-17,26H2,1H3,(H,27,28)/t18-,20-,21-,23-,24+,25-/m0/s1 |
InChIKey | DETLZYCOWYAPEH-ONOIFOFISA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 65 |
Chiral Atom Count | 4 |
Bond Count | 69 |
Aromatic Bond Count | 6 |