Vitas-M small molecule compound
methyl (3E)-4-amino-3-cyano-2-{[(4-methylphenyl)carbonyl]amino}-2-(trifluoromethyl)pent-3-enoate
Catalog ID
STK771439
SMILES COC(=O)C(C(F)(F)F)(/C(=C(\N)/C)/C#N)NC(=O)c1ccc(cc1)C
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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 C16H16F3N3O3 MW 355.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F3N3O3/c1-9-4-6-11(7-5-9)13(23)22-15(14(24)25-3,16(17,18)19)12(8-20)10(2)21/h4-7H,21H2,1-3H3,(H,22,23)/b12-10-InChIKey
CUZHMFZNCDETNI-BENRWUELSA-NSynonyms
(RZ)methyl4amino3cyano2(4methylbenzamido)2(trifluoromethyl)pent3enoate
CC1=CC=C(C=C1)C(=O)NC(C(=C(C)N)C#N)(C(=O)OC)C(F)(F)F
COC(=O)C(C(F)(F)F)(C(=C(N)C)C#N)NC(=O)c1ccc(cc1)C
InChI=1SC16H16F3N3O3c194611(759)13(23)2215(14(24)25316(1718)19)12(820)10(2)21h47H21H213H3(H2223)b1210
METHYL(3E)4AMINO3CYANO2(((4METHYLPHENYL)CARBONYL)AMINO)2(TRIFLUOROMETHYL)PENT3ENOATE
METHYL(E)4AMINO3CYANO2((4METHYLBENZOYL)AMINO)2(TRIFLUOROMETHYL)PENT3ENOATE
MFCD03617170
ZINC000020064494
ZINC000020064496
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