Vitas-M small molecule compound

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

Catalog ID
STK220321
SMILES COc1ccc(cc1)c1nnc(n1CC)SCC(=O)Nc1cccc(c1)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 C19H19BrN4O2S MW 447.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN4O2S/c1-3-24-18(13-7-9-16(26-2)10-8-13)22-23-19(24)27-12-17(25)21-15-6-4-5-14(20)11-15/h4-11H,3,12H2,1-2H3,(H,21,25)
InChIKey
JQDMBVXXPGQOOU-UHFFFAOYSA-N
Synonyms
713493-02-8
713493028
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)Br)C3=CC=C(C=C3)OC
InChI=1SC19H19BrN4O2Sc132418(137916(262)10813)222319(24)271217(25)211564514(20)1115h411H312H212H3(H2125)
MFCD05684098
N(3BROMOPHENYL)2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3bromophenyl)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(3bromophenyl)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)acetamide
N(3BROMOPHENYL)2(4ETHYL5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(3BROMOPHENYL)2(4ETHYL5(4METHOXYPHENYL)4H(124)TRIAZOL3YLSULFANYL)ACETAMIDE
ZINC000001074920
ZINC01074920
ZINC1074920

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Available files

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