Vitas-M small molecule compound

ethyl (2Z)-2-(2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4-carboxylate

Catalog ID
STK871313
SMILES CCOC(=O)C1=CS/C(=C/2\c3ccc(cc3NC(C2=S)(C)C)C)/S1

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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 C18H19NO2S3 MW 377.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO2S3/c1-5-21-16(20)13-9-23-17(24-13)14-11-7-6-10(2)8-12(11)19-18(3,4)15(14)22/h6-9,19H,5H2,1-4H3/b17-14-
InChIKey
QKECSFYDQCZWMX-VKAVYKQESA-N
Synonyms
330830-61-0
(Z)ethyl2(227trimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole4carboxylate
330830610
CCOC(=O)C1=CSC(=C2C3=C(C=C(C=C3)C)NC(C2=S)(C)C)S1
CCOC(=O)C1=CSC(=C2c3ccc(cc3NC(C2=S)(C)C)C)S1
ETHYL(2Z)2(227TRIMETHYL3SULFANYLIDENE1HQUINOLIN4YLIDENE)13DITHIOLE4CARBOXYLATE
ethyl(2Z)2(227trimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole4carboxylate
ETHYL2(227TRIMETHYL3THIOXO412DIHYDROQUINOLYLIDENE)13DITHIOLENE4CARBOXYLATE
InChI=1SC18H19NO2S3c152116(20)1392317(2413)14117610(2)812(11)1918(34)15(14)22h6919H5H214H3b1714
MFCD01955286
ZINC000001170562
ZINC01170562
ZINC1170562

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Available files

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