Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-2-{[5-(2-ethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK468067
SMILES CCOc1ccccc1c1nnc(n1CC)SCC(=O)Nc1nc2c(s1)cccc2
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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 C21H21N5O2S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S2/c1-3-26-19(14-9-5-7-11-16(14)28-4-2)24-25-21(26)29-13-18(27)23-20-22-15-10-6-8-12-17(15)30-20/h5-12H,3-4,13H2,1-2H3,(H,22,23,27)InChIKey
NEGNLIRRBPDWLY-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)C4=CC=CC=C4OCC
InChI=1SC21H21N5O2S2c132619(149571116(14)2842)242521(26)291318(27)2320221510681217(15)3020h512H3413H212H3(H222327)
MFCD07120003
N(13benzothiazol2yl)2((5(2ethoxyphenyl)4ethyl124triazol3yl)sulfanyl)acetamide
N(13benzothiazol2yl)2((5(2ethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)acetamide
NBENZOTHIAZOL2YL2(5(2ETHOXYPHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000019630282
ZINC19630282
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