Vitas-M small molecule compound
1-(1-ethyl-1H-indol-3-yl)-2-({4-ethyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STL122384
SMILES CCn1c(COc2ccc3c(c2)CCCC3)nnc1SCC(=O)c1cn(c2c1cccc2)CC
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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 C27H30N4O2S MW 474.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O2S/c1-3-30-16-23(22-11-7-8-12-24(22)30)25(32)18-34-27-29-28-26(31(27)4-2)17-33-21-14-13-19-9-5-6-10-20(19)15-21/h7-8,11-16H,3-6,9-10,17-18H2,1-2H3InChIKey
FTDRCQYEAJWHMS-UHFFFAOYSA-NSynonyms
1(1ethyl1Hindol3yl)2((4ethyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)ethanone
1(1ethylindol3yl)2((4ethyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)ethanone
CCN1C=C(C2=CC=CC=C21)C(=O)CSC3=NN=C(N3CC)COC4=CC5=C(CCCC5)C=C4
InChI=1SC27H30N4O2Sc13301623(2211781224(22)30)25(32)183427292826(31(27)42)1733211413199561020(19)1521h781116H369101718H212H3
MFCD18434689
ZINC000057291703
ZINC57291703
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