Vitas-M small molecule compound
4-tert-butyl-N-[(2E)-5-[(2-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Catalog ID
STK605074
SMILES O=C(c1ccc(cc1)C(C)(C)C)/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 C20H20FN3O3S2 MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN3O3S2/c1-20(2,3)15-10-8-13(9-11-15)17(25)22-18-23-24-19(28-18)29(26,27)12-14-6-4-5-7-16(14)21/h4-11H,12H2,1-3H3,(H,22,23,25)InChIKey
BQVLZBKIPXLMBI-UHFFFAOYSA-NSynonyms
895840-31-04tertbutylN((2E)5((2fluorobenzyl)sulfonyl)134thiadiazol2(3H)ylidene)benzamide
4tertbutylN(5((2fluorophenyl)methylsulfonyl)134thiadiazol2yl)benzamide
895840310
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3F
InChI=1SC20H20FN3O3S2c120(23)1510813(91115)17(25)2218232419(2818)29(2627)1214645716(14)21h411H12H213H3(H222325)
MFCD08735286
O=C(c1ccc(cc1)C(C)(C)C)N=c1(nH)nc(s1)S(=O)(=O)Cc1ccccc1F
ZINC000009135190
ZINC09135190
ZINC9135190
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