Vitas-M small molecule compound

2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(dimethylamino)phenyl]acetamide

Catalog ID
STL050872
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1COc1ccc(cc1)Cl

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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 C21H24ClN5O2S MW 445.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN5O2S/c1-4-27-19(13-29-18-11-5-15(22)6-12-18)24-25-21(27)30-14-20(28)23-16-7-9-17(10-8-16)26(2)3/h5-12H,4,13-14H2,1-3H3,(H,23,28)
InChIKey
CFWCUFOUTNHZMN-UHFFFAOYSA-N
Synonyms
862106-36-3
2((5((4chlorophenoxy)methyl)4ethyl124triazol3yl)sulfanyl)N(4(dimethylamino)phenyl)acetamide
2((5((4CHLOROPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(4DIMETHYLAMINOPHENYL)ACETAMIDE
2((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)N(4(dimethylamino)phenyl)acetamide
2((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)thio)N(4(dimethylamino)phenyl)acetamide
2((5(4CHLOROPHENOXYMETHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(4(DIMETHYLAMINO)PHENYL)ACETAMIDE
862106363
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N(C)C)COC3=CC=C(C=C3)Cl
InChI=1SC21H24ClN5O2Sc142719(13291811515(22)61218)242521(27)301420(28)23167917(10816)26(2)3h512H41314H213H3(H2328)
MFCD05686875
N(4(DIMETHYLAMINO)PHENYL)2(5((4CHLOROPHENOXY)METHYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009309363
ZINC09309363
ZINC9309363

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Available files

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