Vitas-M small molecule compound
2-{[3-(4-butoxyphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-cyclohexyl-N-methylacetamide
Catalog ID
STL143947
SMILES CCCCOc1ccc(cc1)C1=NC2(N=C1SCC(=O)N(C1CCCCC1)C)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 C27H39N3O2S MW 469.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H39N3O2S/c1-3-4-19-32-23-15-13-21(14-16-23)25-26(29-27(28-25)17-9-6-10-18-27)33-20-24(31)30(2)22-11-7-5-8-12-22/h13-16,22H,3-12,17-20H2,1-2H3InChIKey
GAKTYCVEEWNZRG-UHFFFAOYSA-NSynonyms
2((2(4butoxyphenyl)14diazaspiro(45)deca13dien3yl)sulfanyl)NcyclohexylNmethylacetamide
2((3(4butoxyphenyl)14diazaspiro(45)deca13dien2yl)sulfanyl)NcyclohexylNmethylacetamide
CCCCOC1=CC=C(C=C1)C2=NC3(CCCCC3)N=C2SCC(=O)N(C)C4CCCCC4
InChI=1SC27H39N3O2Sc134193223151321(141623)2526(2927(2825)1796101827)332024(31)30(2)22117581222h131622H3121720H212H3
MFCD20750270
ZINC000071328097
ZINC71328097
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