Vitas-M small molecule compound
(2E)-1-(4-bromo-5-propylthiophen-2-yl)-3-(3-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL176231
SMILES CCCc1sc(cc1Br)C(=O)/C=C/c1cccc(c1)OC
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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 C17H17BrO2S MW 365.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrO2S/c1-3-5-16-14(18)11-17(21-16)15(19)9-8-12-6-4-7-13(10-12)20-2/h4,6-11H,3,5H2,1-2H3/b9-8+InChIKey
PWXBSEWDTCKYKP-CMDGGOBGSA-NSynonyms
832127-54-5(2E)1(4bromo5propylthiophen2yl)3(3methoxyphenyl)prop2en1one
(E)1(4bromo5propylthiophen2yl)3(3methoxyphenyl)prop2en1one
832127545
CCCC1=C(C=C(S1)C(=O)C=CC2=CC(=CC=C2)OC)Br
CCCc1sc(cc1Br)C(=O)C=Cc1cccc(c1)OC
InChI=1SC17H17BrO2Sc1351614(18)1117(2116)15(19)981264713(1012)202h4611H35H212H3b98+
MFCD04135820
ZINC000036611177
ZINC36611177
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