Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-fluoro-2-(1H-tetrazol-1-yl)benzamide

Catalog ID
STK631976
SMILES Fc1ccc(c(c1)n1cnnn1)C(=O)NC1CCS(=O)(=O)C1

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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 C12H12FN5O3S MW 325.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12FN5O3S/c13-8-1-2-10(11(5-8)18-7-14-16-17-18)12(19)15-9-3-4-22(20,21)6-9/h1-2,5,7,9H,3-4,6H2,(H,15,19)
InChIKey
LXPMYAGGNNFFJU-UHFFFAOYSA-N
Synonyms
1040704-90-2
1040704902
C1CS(=O)(=O)CC1NC(=O)C2=C(C=C(C=C2)F)N3C=NN=N3
InChI=1SC12H12FN5O3Sc1381210(11(58)18714161718)12(19)1593422(2021)69h12579H346H2(H1519)
MFCD12208027
N(11dioxidotetrahydrothiophen3yl)4fluoro2(1Htetrazol1yl)benzamide
N(11dioxothiolan3yl)4fluoro2(tetrazol1yl)benzamide
ZINC000020730983
ZINC000020730987

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Available files

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