Vitas-M small molecule compound

ethyl (2Z)-2-[(4-phenylbutanoyl)imino]-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL247583
SMILES CCOC(=O)c1cs/c(=N\C(=O)CCCc2ccccc2)/[nH]1

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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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c1-2-21-15(20)13-11-22-16(17-13)18-14(19)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,2,6,9-10H2,1H3,(H,17,18,19)
InChIKey
HMRDDCGEEOCEBA-UHFFFAOYSA-N
Synonyms
1351696-18-8
1351696188
CCOC(=O)C1=CSC(=N1)NC(=O)CCCC2=CC=CC=C2
CCOC(=O)c1csc(=NC(=O)CCCc2ccccc2)(nH)1
ethyl(2Z)2((4phenylbutanoyl)imino)23dihydro13thiazole4carboxylate
ethyl2(4phenylbutanoylamino)13thiazole4carboxylate
InChI=1SC16H18N2O3Sc122115(20)13112216(1713)1814(19)1069127435812h357811H26910H21H3(H171819)
MFCD24860933
ZINC000042215273
ZINC42215273

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Available files

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