Vitas-M small molecule compound

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

Catalog ID
STK598490
SMILES CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)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 C26H25ClN4O4S MW 525.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O4S/c1-3-34-23-7-5-4-6-22(23)28-25(32)17-36-26-30-29-24(16-35-21-12-8-18(27)9-13-21)31(26)19-10-14-20(33-2)15-11-19/h4-15H,3,16-17H2,1-2H3,(H,28,32)
InChIKey
QLRUWVSRXKIRDX-UHFFFAOYSA-N
Synonyms
896600-13-8
2((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(2ETHOXYPHENYL)ACETAMIDE
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)N(2ethoxyphenyl)acetamide
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(2ethoxyphenyl)acetamide
2((5(4CHLOROPHENOXYMETHYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2ETHOXYPHENYL)ACETAMIDE
2(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(2ETHOXYPHENYL)ACETAMIDE
896600138
CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=C(C=C4)Cl
InChI=1SC26H25ClN4O4Sc133423754622(23)2825(32)173626302924(16352112818(27)91321)31(26)19101420(332)151119h415H31617H212H3(H2832)
MFCD06593327
ZINC000002442173
ZINC02442173
ZINC2442173

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Available files

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