Vitas-M small molecule compound

2-({5-[3-(2,4-dichlorophenoxy)propyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide

Catalog ID
STK186893
SMILES O=C(Nc1cccc(c1)F)CSc1nnc(n1C)CCCOc1ccc(cc1Cl)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 C20H19Cl2FN4O2S MW 469.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Cl2FN4O2S/c1-27-18(6-3-9-29-17-8-7-13(21)10-16(17)22)25-26-20(27)30-12-19(28)24-15-5-2-4-14(23)11-15/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3,(H,24,28)
InChIKey
NYCGWHVOWNOSOH-UHFFFAOYSA-N
Synonyms

2((5(3(24BIS(CHLORANYL)PHENOXY)PROPYL)4METHYL124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ETHANAMIDE
2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL124TRIAZOL3YL)THIO)N(3FLUOROPHENYL)ACETAMIDE
2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL4H124TRIAZOL3YL)THIO)N(3FLUOROPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)F)CCCOC3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H19Cl2FN4O2Sc12718(63929178713(21)1016(17)22)252620(27)301219(28)241552414(23)1115h245781011H36912H21H3(H2428)
MFCD06632596
ZINC000002890396
ZINC02890396
ZINC2890396

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Available files

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