Vitas-M small molecule compound

N-[2-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]-4-methoxybenzamide

Catalog ID
STK186767
SMILES COc1ccc(cc1)C(=O)NCCc1nnc(n1CC)SCC(=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 C22H23BrN4O3S MW 503.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN4O3S/c1-3-27-20(12-13-24-21(29)16-6-10-18(30-2)11-7-16)25-26-22(27)31-14-19(28)15-4-8-17(23)9-5-15/h4-11H,3,12-14H2,1-2H3,(H,24,29)
InChIKey
VEUAGXVSWILGLO-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)CCNC(=O)C3=CC=C(C=C3)OC
InChI=1SC22H23BrN4O3Sc132720(12132421(29)1661018(302)11716)252622(27)311419(28)154817(23)9515h411H31214H212H3(H2429)
MFCD06665898
N(2(5((2(4BROMOPHENYL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
N(2(5(2(4BROMOPHENYL)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
N(2(5(2(4BROMOPHENYL)2OXOETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
ZINC000009262240
ZINC09262240
ZINC9262240

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Available files

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