Vitas-M small molecule compound

methyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-(2-phenylhydrazinyl)alaninate

Catalog ID
STK772456
SMILES COC(=O)C(C(F)(F)F)(NC(=O)Nc1ccc(cc1)F)NNc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H16F4N4O3 MW 400.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F4N4O3/c1-28-14(26)16(17(19,20)21,25-24-13-5-3-2-4-6-13)23-15(27)22-12-9-7-11(18)8-10-12/h2-10,24-25H,1H3,(H2,22,23,27)
InChIKey
IVLBYRJFPLSKLL-UHFFFAOYSA-N
Synonyms
524716-51-6
(S)methyl333trifluoro2(3(4fluorophenyl)ureido)2(2phenylhydrazinyl)propanoate
524716516
COC(=O)C(C(F)(F)F)(NC(=O)NC1=CC=C(C=C1)F)NNC2=CC=CC=C2
InChI=1SC17H16F4N4O3c12814(26)16(17(1920)212524135324613)2315(27)22129711(18)81012h2102425H1H3(H2222327)
METHYL(2R)333TRIFLUORO2(((4FLUOROPHENYL)CARBAMOYL)AMINO)2(2PHENYLHYDRAZINYL)PROPANOATE
METHYL(2S)333TRIFLUORO2(((4FLUOROPHENYL)CARBAMOYL)AMINO)2(2PHENYLHYDRAZINYL)PROPANOATE
METHYL333TRIFLUORO2(((4FLUOROPHENYL)CARBAMOYL)AMINO)2(2PHENYLHYDRAZINO)PROPANOATE
METHYL333TRIFLUORO2((4FLUOROPHENYL)CARBAMOYLAMINO)2(2PHENYLHYDRAZINYL)PROPANOATE
methyl333trifluoroN((4fluorophenyl)carbamoyl)2(2phenylhydrazinyl)alaninate
MFCD03617199
ZINC000002265453
ZINC000002265454

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.