Vitas-M small molecule compound

N-(3,5-dichlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK054333
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1c1cccnc1

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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 C23H19Cl2N5O2S MW 500.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2N5O2S/c1-2-32-20-7-5-19(6-8-20)30-22(15-4-3-9-26-13-15)28-29-23(30)33-14-21(31)27-18-11-16(24)10-17(25)12-18/h3-13H,2,14H2,1H3,(H,27,31)
InChIKey
UNSSOAIGZRIBBN-UHFFFAOYSA-N
Synonyms
499125-75-6
499125756
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC(=C3)Cl)Cl)C4=CN=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1c1cccnc1
InChI=1SC23H19Cl2N5O2Sc1232207519(6820)3022(15439261315)282923(30)331421(31)27181116(24)1017(25)1218h313H214H21H3(H2731)
MFCD03225168
N(35DICHLOROPHENYL)2((4(4ETHOXYPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(35dichlorophenyl)2((4(4ethoxyphenyl)5(pyridin3yl)4H124triazol3yl)thio)acetamide
N(35dichlorophenyl)2((4(4ethoxyphenyl)5pyridin3yl124triazol3yl)sulfanyl)acetamide
STK054333
ZINC000000949973
ZINC00949973
ZINC949973

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Available files

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