Vitas-M small molecule compound

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

Catalog ID
STL042791
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1COc1ccc(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 C26H25ClN4O3S MW 509.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O3S/c1-17-12-18(2)14-20(13-17)28-25(32)16-35-26-30-29-24(15-34-23-8-4-19(27)5-9-23)31(26)21-6-10-22(33-3)11-7-21/h4-14H,15-16H2,1-3H3,(H,28,32)
InChIKey
DBGPNDPFDRNFKH-UHFFFAOYSA-N
Synonyms
848993-16-8
2((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(35DIMETHYLPHENYL)ACETAMIDE
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)N(35dimethylphenyl)acetamide
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(35dimethylphenyl)acetamide
2((5(4CHLOROPHENOXYMETHYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(35DIMETHYLPHENYL)ACETAMIDE
848993168
CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=C(C=C4)Cl)C
InChI=1SC26H25ClN4O3Sc1171218(2)1420(1317)2825(32)163526302924(1534238419(27)5923)31(26)2161022(333)11721h414H1516H213H3(H2832)
MFCD05679166
N(35DIMETHYLPHENYL)2(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002447107
ZINC02447107
ZINC2447107

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Available files

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