Vitas-M small molecule compound

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

Catalog ID
STK014234
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(c(c1)OC)OC

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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 C25H23ClN4O4S MW 511.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O4S/c1-32-20-11-4-16(5-12-20)24-28-29-25(30(24)19-9-6-17(26)7-10-19)35-15-23(31)27-18-8-13-21(33-2)22(14-18)34-3/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey
WTXURZQKJRYNEA-UHFFFAOYSA-N
Synonyms
499101-40-5
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(34dimethoxyphenyl)acetamide
499101405
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC(=C(C=C4)OC)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(c(c1)OC)OC
InChI=1SC25H23ClN4O4Sc1322011416(51220)24282925(30(24)199617(26)71019)351523(31)271881321(332)22(1418)343h414H15H213H3(H2731)
MFCD03223229
N(34DIMETHOXYPHENYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
STK014234
ZINC000000633466
ZINC00633466
ZINC633466

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Available files

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