Vitas-M small molecule compound

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

Catalog ID
STK593727
SMILES CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

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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 C26H25ClN4O3S MW 509.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O3S/c1-3-33-23-7-5-4-6-22(23)28-25(32)17-35-26-30-29-24(16-34-21-14-8-18(2)9-15-21)31(26)20-12-10-19(27)11-13-20/h4-15H,3,16-17H2,1-2H3,(H,28,32)
InChIKey
HNUFFIRMZFWMQH-UHFFFAOYSA-N
Synonyms
899390-35-3
2((4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)N(2ETHOXYPHENYL)ACETAMIDE
2((4(4chlorophenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)N(2ethoxyphenyl)acetamide
2((4(4chlorophenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)N(2ethoxyphenyl)acetamide
2((4(4CHLOROPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)N(2ETHOXYPHENYL)ACETAMIDE
2(4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))N(2ETHOXYPHENYL)ACETAMIDE
899390353
CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)COC4=CC=C(C=C4)C
InChI=1SC26H25ClN4O3Sc133323754622(23)2825(32)173526302924(16342114818(2)91521)31(26)20121019(27)111320h415H31617H212H3(H2832)
MFCD06604805
ZINC000002433296
ZINC02433296
ZINC2433296

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Available files

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