Vitas-M small molecule compound

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

Catalog ID
STK571752
SMILES Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccc(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 C25H23ClN4O2S MW 479.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O2S/c1-17-3-9-20(10-4-17)27-24(31)16-33-25-29-28-23(15-32-22-13-5-18(2)6-14-22)30(25)21-11-7-19(26)8-12-21/h3-14H,15-16H2,1-2H3,(H,27,31)
InChIKey
AXTRRFDZYRTMLV-UHFFFAOYSA-N
Synonyms
899414-73-4
2((4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((4(4chlorophenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2((4(4chlorophenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)N(ptolyl)acetamide
2((4(4CHLOROPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2(4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
899414734
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)COC4=CC=C(C=C4)C
InChI=1SC25H23ClN4O2Sc1173920(10417)2724(31)163325292823(15322213518(2)61422)30(25)2111719(26)81221h314H1516H212H3(H2731)
MFCD06609392
ZINC000002434951
ZINC02434951
ZINC2434951

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Available files

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