Vitas-M small molecule compound

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

Catalog ID
STL299387
SMILES CCOC(=O)CNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1Cl

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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 C20H18Cl2N4O3S MW 465.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N4O3S/c1-2-29-18(28)11-23-17(27)12-30-20-25-24-19(15-5-3-4-6-16(15)22)26(20)14-9-7-13(21)8-10-14/h3-10H,2,11-12H2,1H3,(H,23,27)
InChIKey
SDNBSGNGPONZNZ-UHFFFAOYSA-N
Synonyms
861138-16-1
861138161
CCOC(=O)CNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)Cl)C3=CC=CC=C3Cl
ETHYL2((2((5(2CHLOROPHENYL)4(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ETHYL2(2((5(2CHLOROPHENYL)4(4CHLOROPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ethyl2(2((5(2chlorophenyl)4(4chlorophenyl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2(4(4CHLOROPHENYL)5(2CHLOROPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((5(2chlorophenyl)4(4chlorophenyl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC20H18Cl2N4O3Sc122918(28)112317(27)123020252419(15534616(15)22)26(20)149713(21)81014h310H21112H21H3(H2327)
MFCD05683621
ZINC000009307869
ZINC09307869
ZINC9307869

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Available files

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