Vitas-M small molecule compound
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({4-ethyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK251442
SMILES CCn1c(COc2ccc3c(c2)CCCC3)nnc1SCC(=O)N1CCCc2c1cccc2
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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 C26H30N4O2S MW 462.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O2S/c1-2-29-24(17-32-22-14-13-19-8-3-4-10-21(19)16-22)27-28-26(29)33-18-25(31)30-15-7-11-20-9-5-6-12-23(20)30/h5-6,9,12-14,16H,2-4,7-8,10-11,15,17-18H2,1H3InChIKey
HJHZTWGGQMYEMB-UHFFFAOYSA-NSynonyms
1(34dihydro2Hquinolin1yl)2((4ethyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)ethanone
1(34dihydroquinolin1(2H)yl)2((4ethyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)ethanone
CCN1C(=NN=C1SCC(=O)N2CCCC3=CC=CC=C32)COC4=CC5=C(CCCC5)C=C4
InChI=1SC26H30N4O2Sc122924(1732221413198341021(19)1622)272826(29)331825(31)3015711209561223(20)30h569121416H24781011151718H21H3
MFCD08670928
ZINC000009699399
ZINC09699399
ZINC9699399
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