Vitas-M small molecule compound

methyl 3,3,3-trifluoro-N-(furan-2-ylcarbonyl)-2-({5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}amino)alaninate

Catalog ID
STL335786
SMILES COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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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 C18H13F3N4O8S2 MW 534.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N4O8S2/c1-32-15(27)17(18(19,20)21,23-14(26)12-3-2-8-33-12)24-16-22-9-13(34-16)35(30,31)11-6-4-10(5-7-11)25(28)29/h2-9H,1H3,(H,22,24)(H,23,26)
InChIKey
SQSVRVYJBNGBEX-UHFFFAOYSA-N
Synonyms
500103-69-5
(S)methyl333trifluoro2(furan2carboxamido)2((5((4nitrophenyl)sulfonyl)thiazol2yl)amino)propanoate
500103695
COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
COC(=O)C(C(F)(F)F)(NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)(N+)(=O)(O))NC(=O)C3=CC=CO3
InChI=1SC18H13F3N4O8S2c13215(27)17(18(1920)212314(26)123283312)241622913(3416)35(3031)116410(5711)25(28)29h29H1H3(H2224)(H2326)
METHYL333TRIFLUORO2((FURAN2YLCARBONYL)AMINO)N(5((4NITROPHENYL)SULFONYL)13THIAZOL2YL)ALANINATE
METHYL333TRIFLUORO2((FURAN2YLCARBONYL)AMINO)N(5((4NITROPHENYL)SULFONYL)13THIAZOL2YL)LALANINATE
METHYL333TRIFLUORO2(FURAN2CARBONYLAMINO)2((5(4NITROPHENYL)SULFONYL13THIAZOL2YL)AMINO)PROPANOATE
methyl333trifluoroN(furan2ylcarbonyl)2((5((4nitrophenyl)sulfonyl)13thiazol2yl)amino)alaninate
MFCD03303931
ZINC000002357303
ZINC000002357304

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Available files

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