Vitas-M small molecule compound

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

Catalog ID
STK307015
SMILES C=CCNC(=O)CSc1nnc(n1C)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 C14H15BrN4OS MW 367.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrN4OS/c1-3-8-16-12(20)9-21-14-18-17-13(19(14)2)10-4-6-11(15)7-5-10/h3-7H,1,8-9H2,2H3,(H,16,20)
InChIKey
QVPAJIZRBVYTAX-UHFFFAOYSA-N
Synonyms
828287-22-5
2((5(4BROMOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)NPROP2ENYLACETAMIDE
2((5(4bromophenyl)4methyl4H124triazol3yl)sulfanyl)N(prop2en1yl)acetamide
828287225
CN1C(=NN=C1SCC(=O)NCC=C)C2=CC=C(C=C2)Br
InChI=1SC14H15BrN4OSc1381612(20)92114181713(19(14)2)104611(15)7510h37H189H22H3(H1620)
MFCD04130398
ZINC000002792454
ZINC02792454
ZINC2792454

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Available files

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