Vitas-M small molecule compound

3-{[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]amino}-5-phenyl-2-propanoylcyclohex-2-en-1-one

Catalog ID
STK681216
SMILES CCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(C)cc3)CC(CC1=O)c1ccccc1

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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 C27H30N2O2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O2/c1-4-25(30)27-24(15-20(16-26(27)31)19-8-6-5-7-9-19)28-13-12-21-18(3)29-23-11-10-17(2)14-22(21)23/h5-11,14,20,28-29H,4,12-13,15-16H2,1-3H3
InChIKey
UMPVBXDZIILERP-UHFFFAOYSA-N
Synonyms

3((2(25dimethyl1Hindol3yl)ethyl)amino)5phenyl2propanoylcyclohex2en1one
3((2(25DIMETHYL1HINDOL3YL)ETHYL)AMINO)5PHENYL2PROPIONYLCYCLOHEX2EN1ONE
3(2(25DIMETHYL1HINDOL3YL)ETHYLAMINO)2(1OXOPROPYL)5PHENYL1CYCLOHEX2ENONE
3(2(25DIMETHYL1HINDOL3YL)ETHYLAMINO)5PHENYL2PROPANOYLCYCLOHEX2EN1ONE
3(2(25DIMETHYL1HINDOL3YL)ETHYLAMINO)5PHENYL2PROPIONYLCYCLOHEX2EN1ONE
CCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=C3C=C(C=C4)C)C
CCC(=O)C1=C(NCCc2c(C)(nH)c3c2cc(C)cc3)CC(CC1=O)c1ccccc1
InChI=1SC27H30N2O2c1425(30)2724(1520(1626(27)31)198657919)2813122118(3)2923111017(2)1422(21)23h51114202829H412131516H213H3
MFCD03768672
ZINC000001076639
ZINC000001076643

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Available files

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