Vitas-M small molecule compound

N-(2-chlorophenyl)-2-({5-[(2,6-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STK119235
SMILES O=C(Nc1ccccc1Cl)CSc1nnc(n1C)COc1c(C)cccc1C

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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 C20H21ClN4O2S MW 416.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O2S/c1-13-7-6-8-14(2)19(13)27-11-17-23-24-20(25(17)3)28-12-18(26)22-16-10-5-4-9-15(16)21/h4-10H,11-12H2,1-3H3,(H,22,26)
InChIKey
LEWZCDNELKMSBX-UHFFFAOYSA-N
Synonyms

CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C)SCC(=O)NC3=CC=CC=C3Cl
InChI=1SC20H21ClN4O2Sc11376814(2)19(13)271117232420(25(17)3)281218(26)22161054915(16)21h410H1112H213H3(H2226)
MFCD04128196
N(2CHLOROPHENYL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2CHLOROPHENYL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001417386
ZINC01417386
ZINC1417386

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Available files

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