Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK289107
SMILES C=CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1c1ccco1
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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-2-10-24-19(17-8-5-12-26-17)21-22-20(24)27-14-18(25)23-11-9-15-6-3-4-7-16(15)13-23/h2-8,12H,1,9-11,13-14H2InChIKey
JRIQGRPXFMIIPB-UHFFFAOYSA-NSynonyms
1(34dihydro1Hisoquinolin2yl)2((5(furan2yl)4prop2enyl124triazol3yl)sulfanyl)ethanone
1(34dihydroisoquinolin2(1H)yl)2((5(furan2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)ethanone
C=CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CO4
InChI=1SC20H20N4O2Sc12102419(1785122617)212220(24)271418(25)2311915634716(15)1323h2812H19111314H2
MFCD09039573
ZINC000013567149
ZINC13567149
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