Vitas-M small molecule compound
4-[({[4-(prop-2-en-1-yl)-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STK328663
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1C12CC3CC(C2)CC(C1)C3
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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 C24H28N4O3S MW 452.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O3S/c1-2-7-28-22(24-11-15-8-16(12-24)10-17(9-15)13-24)26-27-23(28)32-14-20(29)25-19-5-3-18(4-6-19)21(30)31/h2-6,15-17H,1,7-14H2,(H,25,29)(H,30,31)InChIKey
MJVYOBFIBUBEEE-UHFFFAOYSA-NSynonyms
933210-25-44((((4(prop2en1yl)5(tricyclo(3311~37~)dec1yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4((2((5(1adamantyl)4prop2enyl124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
933210254
C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)O)C34CC5CC(C3)CC(C5)C4
InChI=1SC24H28N4O3Sc1272822(241115816(1224)1017(915)1324)262723(28)321420(29)25195318(4619)21(30)31h261517H1714H2(H2529)(H3031)
MFCD09468088
ZINC000018191135
ZINC18191135
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