Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(5-methylthiophen-2-yl)prop-2-en-1-one
Catalog ID
STL171609
SMILES Cc1ccc(s1)C(=O)/C=C/c1ccc2c(c1)OCO2
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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 C15H12O3S MW 272.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12O3S/c1-10-2-7-15(19-10)12(16)5-3-11-4-6-13-14(8-11)18-9-17-13/h2-8H,9H2,1H3/b5-3+InChIKey
PGSFPCJCBAQZAV-HWKANZROSA-NSynonyms
677294-12-1(2E)3(13benzodioxol5yl)1(5methylthiophen2yl)prop2en1one
(E)3(13benzodioxol5yl)1(5methylthiophen2yl)prop2en1one
677294121
CC1=CC=C(S1)C(=O)C=CC2=CC3=C(C=C2)OCO3
Cc1ccc(s1)C(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC15H12O3Sc1102715(1910)12(16)5311461314(811)1891713h28H9H21H3b53+
MFCD04046217
ZINC000006788918
ZINC06788918
ZINC6788918
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