Vitas-M small molecule compound

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

Catalog ID
STK090498
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)N(C)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 C25H24ClN5O2S MW 494.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5O2S/c1-30(2)20-12-8-19(9-13-20)27-23(32)16-34-25-29-28-24(17-4-14-22(33-3)15-5-17)31(25)21-10-6-18(26)7-11-21/h4-15H,16H2,1-3H3,(H,27,32)
InChIKey
WUERWNYMICLGQM-UHFFFAOYSA-N
Synonyms
499101-44-9
2((4(4chlorophenyl)5(4methoxyphenyl)124triazol3yl)sulfanyl)N(4(dimethylamino)phenyl)acetamide
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4(DIMETHYLAMINO)PHENYL)ACETAMIDE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(4(dimethylamino)phenyl)acetamide
499101449
CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)N(C)C
InChI=1SC25H24ClN5O2Sc130(2)2012819(91320)2723(32)163425292824(1741422(333)15517)31(25)2110618(26)71121h415H16H213H3(H2732)
MFCD03223236
N(4(DIMETHYLAMINO)PHENYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
STK090498
ZINC000000949954
ZINC00949954
ZINC949954

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Available files

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