Vitas-M small molecule compound

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

Catalog ID
STL053164
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1)F

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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 C24H21FN4O2S MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN4O2S/c1-16-3-11-20(12-4-16)29-23(17-5-13-21(31-2)14-6-17)27-28-24(29)32-15-22(30)26-19-9-7-18(25)8-10-19/h3-14H,15H2,1-2H3,(H,26,30)
InChIKey
SARWNFQJTUQCNH-UHFFFAOYSA-N
Synonyms
848922-22-5
848922225
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC
InChI=1SC24H21FN4O2Sc11631120(12416)2923(1751321(312)14617)272824(29)321522(30)26199718(25)81019h314H15H212H3(H2630)
MFCD05319631
N(4FLUOROPHENYL)2((5(4METHOXYPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4fluorophenyl)2((5(4methoxyphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4fluorophenyl)2((5(4methoxyphenyl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(4FLUOROPHENYL)2(5(4METHOXYPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002442880
ZINC02442880
ZINC2442880

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Available files

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