Vitas-M small molecule compound

(2E)-3-(5-methylthiophen-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one

Catalog ID
STL177525
SMILES Cc1ccc(s1)/C=C/C(=O)c1cccc(c1)[N+](=O)[O-]

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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 C14H11NO3S MW 273.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11NO3S/c1-10-5-6-13(19-10)7-8-14(16)11-3-2-4-12(9-11)15(17)18/h2-9H,1H3/b8-7+
InChIKey
RFDVSRVGFGDONC-BQYQJAHWSA-N
Synonyms
1440663-62-6
(2E)3(5METHYL(2THIENYL))1(3NITROPHENYL)PROP2EN1ONE
(2E)3(5methylthiophen2yl)1(3nitrophenyl)prop2en1one
(E)3(5METHYLTHIOPHEN2YL)1(3NITROPHENYL)PROP2EN1ONE
1440663626
CC1=CC=C(S1)C=CC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
Cc1ccc(s1)C=CC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC14H11NO3Sc1105613(1910)7814(16)1132412(911)15(17)18h29H1H3b87+
MFCD04054179
ZINC000006339147
ZINC06339147
ZINC6339147

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Available files

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