CHEBI:127834 - 1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea

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ChEBI Name 1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea ChEBI ID CHEBI:127834 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 C32H37F3N4O7S Net Charge 0 Average Mass 678.721 Monoisotopic Mass 678.23351 InChI InChI=1S/C32H37F3N4O7S/c1-20-17-39(21(2)19-40)30(41)16-22-15-25(37-31(42)36-24-7-5-23(6-8-24)32(33,34)35)9-14-28(22)46-29(20)18-38(3)47(43,44)27-12-10-26(45-4)11-13-27/h5-15,20-21,29,40H,16-19H2,1-4H3,(H2,36,37,42)/t20-,21-,29-/m1/s1 InChIKey AIWMNFKLTIXQRS-GVNDJSPXSA-N SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F)O[C@@H]1CN(C)S(=O)(=O)C4=CC=C(C=C4)OC)[C@H](C)CO ChEBI Ontology Outgoing 1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea (CHEBI:127834) is a sulfonamide (CHEBI:35358) Manual Xref Database LSM-39390 LINCS View more database links