Vitas-M small molecule compound

N-[(2E)-5-[(2-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-methylbenzamide

Catalog ID
STK615384
SMILES Cc1cccc(c1)C(=O)/N=c/1\[nH]nc(s1)S(=O)(=O)Cc1ccccc1F

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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 C17H14FN3O3S2 MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14FN3O3S2/c1-11-5-4-7-12(9-11)15(22)19-16-20-21-17(25-16)26(23,24)10-13-6-2-3-8-14(13)18/h2-9H,10H2,1H3,(H,19,20,22)
InChIKey
NHRKDEXNSCNPLN-UHFFFAOYSA-N
Synonyms
895847-93-5
895847935
CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3F
Cc1cccc(c1)C(=O)N=c1(nH)nc(s1)S(=O)(=O)Cc1ccccc1F
InChI=1SC17H14FN3O3S2c11154712(911)15(22)1916202117(2516)26(2324)1013623814(13)18h29H10H21H3(H192022)
MFCD08736205
N((2E)5((2fluorobenzyl)sulfonyl)134thiadiazol2(3H)ylidene)3methylbenzamide
N(5((2fluorophenyl)methylsulfonyl)134thiadiazol2yl)3methylbenzamide
ZINC000009304837
ZINC09304837
ZINC9304837

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Available files

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