CHEBI:108703 - N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide

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ChEBI Name N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide ChEBI ID CHEBI:108703 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C31H39F3N4O5 Net Charge 0 Average Mass 604.662 Monoisotopic Mass 604.28725 InChI InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27-/m1/s1 InChIKey AZWNSNCWAAAZSD-IOKPGSKQSA-N SMILES C[C@@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)C3CCCCC3)O[C@@H]1CN(C)C(=O)NC4=CC=C(C=C4)C(F)(F)F)[C@@H](C)CO ChEBI Ontology Outgoing N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide (CHEBI:108703) is a ureas (CHEBI:47857) Manual Xref Database LSM-20102 LINCS View more database links