Vitas-M small molecule compound

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

Catalog ID
STK244461
SMILES O=C(Nc1ccccc1Cl)CSc1nnc(n1C)c1ccc(cc1Cl)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 C18H16Cl2N4OS MW 407.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N4OS/c1-11-7-8-12(14(20)9-11)17-22-23-18(24(17)2)26-10-16(25)21-15-6-4-3-5-13(15)19/h3-9H,10H2,1-2H3,(H,21,25)
InChIKey
XVNZPOACPYQSPF-UHFFFAOYSA-N
Synonyms

2((5(2CHLORO4METHYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N(2CHLOROPHENYL)ACETAMIDE
2((5(2chloro4methylphenyl)4methyl4H124triazol3yl)sulfanyl)N(2chlorophenyl)acetamide
CC1=CC(=C(C=C1)C2=NN=C(N2C)SCC(=O)NC3=CC=CC=C3Cl)Cl
InChI=1SC18H16Cl2N4OSc1117812(14(20)911)17222318(24(17)2)261016(25)2115643513(15)19h39H10H212H3(H2125)
MFCD05995211
ZINC000001125131
ZINC01125131
ZINC1125131

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Available files

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