Vitas-M small molecule compound

N-(4-nitrophenyl)-2-[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide

Catalog ID
STL020138
SMILES O=C(CC1Sc2ccc(cc2NC1=O)C(F)(F)F)Nc1ccc(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 C17H12F3N3O4S MW 411.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3N3O4S/c18-17(19,20)9-1-6-13-12(7-9)22-16(25)14(28-13)8-15(24)21-10-2-4-11(5-3-10)23(26)27/h1-7,14H,8H2,(H,21,24)(H,22,25)
InChIKey
BPEOAIDGXHPDIH-UHFFFAOYSA-N
Synonyms
302552-51-8
302552518
C1=CC(=CC=C1NC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)C(F)(F)F)(N+)(=O)(O)
InChI=1SC17H12F3N3O4Sc1817(1920)9161312(79)2216(25)14(2813)815(24)21102411(5310)23(26)27h1714H8H2(H2124)(H2225)
MFCD01817581
N(4NITROPHENYL)2(3OXO6(TRIFLUOROMETHYL)(2H4HBENZO(E)14THIAZIN2YL))ACETAMIDE
N(4nitrophenyl)2(3oxo6(trifluoromethyl)34dihydro2H14benzothiazin2yl)acetamide
N(4NITROPHENYL)2(3OXO6(TRIFLUOROMETHYL)34DIHYDRO2HBENZO(B)(14)THIAZIN2YL)ACETAMIDE
N(4NITROPHENYL)2(3OXO6(TRIFLUOROMETHYL)4H14BENZOTHIAZIN2YL)ACETAMIDE
O=C(CC1Sc2ccc(cc2NC1=O)C(F)(F)F)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000004158871
ZINC000004158872

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Available files

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