Vitas-M small molecule compound

ethyl N-({[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate

Catalog ID
STK556926
SMILES CCOC(=O)CNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

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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 C19H18ClN5O3S MW 431.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O3S/c1-2-28-17(27)11-22-16(26)12-29-19-24-23-18(13-7-9-21-10-8-13)25(19)15-5-3-14(20)4-6-15/h3-10H,2,11-12H2,1H3,(H,22,26)
InChIKey
HLYQIHXOSYSNMO-UHFFFAOYSA-N
Synonyms
577980-80-4
(2(4(4CHLOROPHENYL)5PYRIDIN4YL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)ACETICACIDETHYLESTER
577980804
CCOC(=O)CNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)Cl)C3=CC=NC=C3
ETHYL2((2((4(4CHLOROPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ETHYL2(2((4(4CHLOROPHENYL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ethyl2(2((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2(4(4CHLOROPHENYL)5(4PYRIDYL)124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC19H18ClN5O3Sc122817(27)112216(26)122919242318(13792110813)25(19)155314(20)4615h310H21112H21H3(H2226)
MFCD03473383
ZINC000002323173
ZINC02323173
ZINC2323173

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Available files

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