Vitas-M small molecule compound

1,3-diethyl-5-(naphthalen-1-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL380032
SMILES CCN1C(=O)C(=Cc2cccc3c2cccc3)C(=O)N(C1=S)CC

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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 C19H18N2O2S MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O2S/c1-3-20-17(22)16(18(23)21(4-2)19(20)24)12-14-10-7-9-13-8-5-6-11-15(13)14/h5-12H,3-4H2,1-2H3
InChIKey
HQIQTGMLGLNCOE-UHFFFAOYSA-N
Synonyms

13DIETHYL5(NAPHTHALEN1YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
13diethyl5(naphthalen1ylmethylidene)2thioxodihydropyrimidine46(1H5H)dione
13DIETHYL5(NAPHTHYLMETHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
CCN1C(=O)C(=CC2=CC=CC3=CC=CC=C32)C(=O)N(C1=S)CC
InChI=1SC19H18N2O2Sc132017(22)16(18(23)21(42)19(20)24)12141079138561115(13)14h512H34H212H3
MFCD01175626
ZINC000005455844
ZINC05455844
ZINC5455844

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Available files

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