Vitas-M small molecule compound

(5E)-2-[4-(naphthalen-1-yl)piperazin-1-yl]-5-(2-propoxybenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK540103
SMILES CCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1cccc2c1cccc2

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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 C27H27N3O2S MW 457.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2S/c1-2-18-32-24-13-6-4-9-21(24)19-25-26(31)28-27(33-25)30-16-14-29(15-17-30)23-12-7-10-20-8-3-5-11-22(20)23/h3-13,19H,2,14-18H2,1H3/b25-19+
InChIKey
NUJPAGMLDNWYNO-NCELDCMTSA-N
Synonyms
385390-80-7
(5E)2(4(naphthalen1yl)piperazin1yl)5(2propoxybenzylidene)13thiazol4(5H)one
(5E)2(4NAPHTHALEN1YLPIPERAZIN1YL)5((2PROPOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(E)2(4(naphthalen1yl)piperazin1yl)5(2propoxybenzylidene)thiazol4(5H)one
385390807
CCCOC1=CC=CC=C1C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC5=CC=CC=C54
CCCOc1ccccc1C=C1SC(=NC1=O)N1CCN(CC1)c1cccc2c1cccc2
InChI=1SC27H27N3O2Sc121832241364921(24)192526(31)2827(3325)30161429(151730)2312710208351122(20)23h31319H21418H21H3b2519+
MFCD03285695
ZINC000002320159
ZINC02320159
ZINC2320159

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.