Vitas-M small molecule compound
2-{[5-(1,3-benzodioxol-5-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,3-dihydro-1H-indol-1-yl)ethanone
Catalog ID
STK231074
SMILES C=CCn1c(SCC(=O)N2CCc3c2cccc3)nnc1c1ccc2c(c1)OCO2
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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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-2-10-26-21(16-7-8-18-19(12-16)29-14-28-18)23-24-22(26)30-13-20(27)25-11-9-15-5-3-4-6-17(15)25/h2-8,12H,1,9-11,13-14H2InChIKey
HQVCMCMPVYNBSK-UHFFFAOYSA-NSynonyms
2((5(13benzodioxol5yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)1(23dihydro1Hindol1yl)ethanone
2((5(13BENZODIOXOL5YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1(23DIHYDROINDOL1YL)ETHANONE
C=CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5
InChI=1SC22H20N4O3Sc12102621(16781819(1216)29142818)232422(26)301320(27)2511915534617(15)25h2812H19111314H2
MFCD07791866
ZINC000009290076
ZINC09290076
ZINC9290076
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