Vitas-M small molecule compound

N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide

Catalog ID
STK297130
SMILES COc1ccc2c(c1)sc(n2)NC(=O)CSc1nnc[nH]1

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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 C12H11N5O2S2 MW 321.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O2S2/c1-19-7-2-3-8-9(4-7)21-12(15-8)16-10(18)5-20-11-13-6-14-17-11/h2-4,6H,5H2,1H3,(H,13,14,17)(H,15,16,18)
InChIKey
NEXAZZIWCIMDQD-UHFFFAOYSA-N
Synonyms

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC=NN3
COc1ccc2c(c1)sc(n2)NC(=O)CSc1nnc(nH)1
InChI=1SC12H11N5O2S2c11972389(47)2112(158)1610(18)52011136141711h246H5H21H3(H131417)(H151618)
MFCD09960752
N(6METHOXY13BENZOTHIAZOL2YL)2(1H124TRIAZOL5YLSULFANYL)ACETAMIDE
N(6methoxy13benzothiazol2yl)2(4H124triazol3ylsulfanyl)acetamide
ZINC000008333398
ZINC08333398
ZINC8333398

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Available files

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