Vitas-M small molecule compound

(2E)-3-(4-tert-butylphenyl)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]prop-2-en-1-one

Catalog ID
STK428241
SMILES CCOc1ccccc1N1CCN(CC1)C(=O)/C=C/c1ccc(cc1)C(C)(C)C

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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 C25H32N2O2 MW 392.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O2/c1-5-29-23-9-7-6-8-22(23)26-16-18-27(19-17-26)24(28)15-12-20-10-13-21(14-11-20)25(2,3)4/h6-15H,5,16-19H2,1-4H3/b15-12+
InChIKey
WSODGFPKIJCUMS-NTCAYCPXSA-N
Synonyms
5692-96-6
(2E)3(4(TERTBUTYL)PHENYL)1(4(2ETHOXYPHENYL)PIPERAZINYL)PROP2EN1ONE
(2E)3(4tertbutylphenyl)1(4(2ethoxyphenyl)piperazin1yl)prop2en1one
(E)3(4TERTBUTYLPHENYL)1(4(2ETHOXYPHENYL)PIPERAZIN1YL)PROP2EN1ONE
5692966
CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)C(C)(C)C
CCOc1ccccc1N1CCN(CC1)C(=O)C=Cc1ccc(cc1)C(C)(C)C
InChI=1SC25H32N2O2c152923976822(23)26161827(191726)24(28)151220101321(141120)25(23)4h615H51619H214H3b1512+
MFCD01341747
ZINC000001199936
ZINC01199936
ZINC1199936

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Available files

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