Vitas-M small molecule compound

N-(4-bromo-3-chlorophenyl)-2-{[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK121282
SMILES O=C(Nc1ccc(c(c1)Cl)Br)CSc1nnc(n1C)c1ccc(cc1)C

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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 C18H16BrClN4OS MW 451.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrClN4OS/c1-11-3-5-12(6-4-11)17-22-23-18(24(17)2)26-10-16(25)21-13-7-8-14(19)15(20)9-13/h3-9H,10H2,1-2H3,(H,21,25)
InChIKey
QSJHENFSZPKBEN-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC3=CC(=C(C=C3)Br)Cl
InChI=1SC18H16BrClN4OSc1113512(6411)17222318(24(17)2)261016(25)21137814(19)15(20)913h39H10H212H3(H2125)
MFCD04380553
N(4BROMO3CHLOROPHENYL)2((4METHYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO3CHLOROPHENYL)2((4METHYL5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002859600
ZINC02859600
ZINC2859600

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Available files

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