Vitas-M small molecule compound

methyl {[5-(3,6-dichloro-1-benzothiophen-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

Catalog ID
STK807402
SMILES COC(=O)CSc1nnc(n1C)c1sc2c(c1Cl)ccc(c2)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 C14H11Cl2N3O2S2 MW 388.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11Cl2N3O2S2/c1-19-13(17-18-14(19)22-6-10(20)21-2)12-11(16)8-4-3-7(15)5-9(8)23-12/h3-5H,6H2,1-2H3
InChIKey
ZARKRRUNTZGHLM-UHFFFAOYSA-N
Synonyms

CN1C(=NN=C1SCC(=O)OC)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl
InChI=1SC14H11Cl2N3O2S2c11913(171814(19)22610(20)212)1211(16)8437(15)59(8)2312h35H6H212H3
methyl((5(36dichloro1benzothiophen2yl)4methyl4H124triazol3yl)sulfanyl)acetate
METHYL2((5(36DICHLORO1BENZOTHIOPHEN2YL)4METHYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(5(36DICHLOROBENZO(B)THIOPHEN2YL)4METHYL124TRIAZOL3YLTHIO)ACETATE
MFCD04218928
ZINC000001114595
ZINC01114595
ZINC1114595

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Available files

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