Vitas-M small molecule compound
2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)pentylidene]cyclohexane-1,3-dione
Catalog ID
STK681259
SMILES CCCCC(=C1C(=O)CCCC1=O)NCCc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2
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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 C29H34N2O3 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O3/c1-3-4-11-26(29-27(32)12-8-13-28(29)33)30-17-16-23-20(2)31-25-15-14-22(18-24(23)25)34-19-21-9-6-5-7-10-21/h5-7,9-10,14-15,18,30-31H,3-4,8,11-13,16-17,19H2,1-2H3InChIKey
KLHPFINJKSRNHR-UHFFFAOYSA-NSynonyms
2(1((2(5(benzyloxy)2methyl1Hindol3yl)ethyl)amino)pentylidene)cyclohexane13dione
2(1(2(2METHYL5PHENYLMETHOXY1HINDOL3YL)ETHYLAMINO)PENTYLIDENE)CYCLOHEXANE13DIONE
CCCCC(=C1C(=O)CCCC1=O)NCCc1c(C)(nH)c2c1cc(OCc1ccccc1)cc2
CCCCC(=C1C(=O)CCCC1=O)NCCC2=C(NC3=C2C=C(C=C3)OCC4=CC=CC=C4)C
InChI=1SC29H34N2O3c1341126(2927(32)1281328(29)33)3017162320(2)3125151422(1824(23)25)34192196571021h579101415183031H3481113161719H212H3
MFCD03768769
ZINC000100140325
ZINC100140325
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