Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-2-{[3-(4-butoxyphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Catalog ID
STL143941
SMILES CCCCOc1ccc(cc1)C1=NC2(N=C1SCC(=O)Nc1ccc(cc1F)Br)CCCCC2
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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 C26H29BrFN3O2S MW 546.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29BrFN3O2S/c1-2-3-15-33-20-10-7-18(8-11-20)24-25(31-26(30-24)13-5-4-6-14-26)34-17-23(32)29-22-12-9-19(27)16-21(22)28/h7-12,16H,2-6,13-15,17H2,1H3,(H,29,32)InChIKey
VLBKQSWNTOXXRO-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=C(C=C1)C2=NC3(CCCCC3)N=C2SCC(=O)NC4=C(C=C(C=C4)Br)F
InChI=1SC26H29BrFN3O2Sc12315332010718(81120)2425(3126(3024)135461426)341723(32)292212919(27)1621(22)28h71216H26131517H21H3(H2932)
MFCD20750264
N(4bromo2fluorophenyl)2((2(4butoxyphenyl)14diazaspiro(45)deca13dien3yl)sulfanyl)acetamide
N(4bromo2fluorophenyl)2((3(4butoxyphenyl)14diazaspiro(45)deca13dien2yl)sulfanyl)acetamide
ZINC000102918340
ZINC102918340
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