Vitas-M small molecule compound
N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-N~2~-(2-fluorobenzyl)-N-tricyclo[3.3.1.1~3,7~]dec-1-ylglycinamide
Catalog ID
STL439336
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)CN(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccccc1F
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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 C35H42FN3O2 MW 555.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H42FN3O2/c1-21-32(26-9-5-7-11-29(26)37-21)33-27(34(33,2)3)15-31(41)39(19-25-8-4-6-10-28(25)36)20-30(40)38-35-16-22-12-23(17-35)14-24(13-22)18-35/h4-11,22-24,27,33,37H,12-20H2,1-3H3,(H,38,40)InChIKey
GTJUTTFWSKMSBS-UHFFFAOYSA-NSynonyms
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CC=C4F)CC(=O)NC56CC7CC(C5)CC(C7)C6
InChI=1SC35H42FN3O2c12132(269571129(26)3721)3327(34(332)3)1531(41)39(19258461028(25)36)2030(40)383516221223(1735)1424(1322)1835h4112224273337H1220H213H3(H3840)
N(2(1ADAMANTYLAMINO)2OXOETHYL)2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N((2FLUOROPHENYL)METHYL)ACETAMIDE
N~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)N~2~(2fluorobenzyl)Ntricyclo(3311~37~)dec1ylglycinamide
O=C(NC12CC3CC(C2)CC(C1)C3)CN(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccccc1F
ZINC000008748950
ZINC000108461910
Check stock
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Check stock on Vitas-MAvailable files
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