Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STL347645
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)F)nnc1c1ccc(cc1)C(C)(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 C23H25FN4OS MW 424.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN4OS/c1-5-14-28-21(16-6-8-17(9-7-16)23(2,3)4)26-27-22(28)30-15-20(29)25-19-12-10-18(24)11-13-19/h5-13H,1,14-15H2,2-4H3,(H,25,29)InChIKey
POUKFGBJOYCGGV-UHFFFAOYSA-NSynonyms
861123-66-22((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(4fluorophenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
861123662
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC23H25FN4OSc15142821(166817(9716)23(23)4)262722(28)301520(29)2519121018(24)111319h513H11415H224H3(H2529)
MFCD05683549
ZINC000005478042
ZINC05478042
ZINC5478042
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