Vitas-M small molecule compound
N-[2-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]-3,4-dichlorobenzamide
Catalog ID
STK186764
SMILES CCn1c(CCNC(=O)c2ccc(c(c2)Cl)Cl)nnc1SCC(=O)c1ccc(cc1)Br
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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 C21H19BrCl2N4O2S MW 542.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrCl2N4O2S/c1-2-28-19(9-10-25-20(30)14-5-8-16(23)17(24)11-14)26-27-21(28)31-12-18(29)13-3-6-15(22)7-4-13/h3-8,11H,2,9-10,12H2,1H3,(H,25,30)InChIKey
SRRRCOXLDPREHO-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H19BrCl2N4O2Sc122819(9102520(30)145816(23)17(24)1114)262721(28)311218(29)133615(22)7413h3811H291012H21H3(H2530)
MFCD06003412
N(2(5((2(4BROMOPHENYL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)34DICHLOROBENZAMIDE
N(2(5(2(4BROMOPHENYL)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)34DICHLOROBENZAMIDE
N(2(5(2(4BROMOPHENYL)2OXOETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)34DICHLOROBENZAMIDE
ZINC000001050523
ZINC1050523
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