Vitas-M small molecule compound

ethyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate

Catalog ID
STK502585
SMILES CCOC(=O)c1c(N=C=S)sc(c1c1ccccc1)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 C15H13NO2S2 MW 303.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO2S2/c1-3-18-15(17)13-12(11-7-5-4-6-8-11)10(2)20-14(13)16-9-19/h4-8H,3H2,1-2H3
InChIKey
ZSNJPZUOQCYMNP-UHFFFAOYSA-N
Synonyms
861239-52-3
861239523
CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N=C=S
ethyl2isothiocyanato5methyl4phenylthiophene3carboxylate
InChI=1SC15H13NO2S2c131815(17)1312(117546811)10(2)2014(13)16919h48H3H212H3
MFCD04969627
ZINC000002537452
ZINC02537452
ZINC2537452

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Available files

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