Vitas-M small molecule compound

diethyl 6'-ethyl-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate

Catalog ID
STK871130
SMILES CCOC(=O)C1=CSC2(S1)C=C(SC1=C2c2ccccc2N(C1(C)C)CC)C(=O)OCC

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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 C24H27NO4S3 MW 489.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO4S3/c1-6-25-16-12-10-9-11-15(16)19-20(23(25,4)5)31-17(21(26)28-7-2)13-24(19)30-14-18(32-24)22(27)29-8-3/h9-14H,6-8H2,1-5H3
InChIKey
GUIASQRDXQIVKM-UHFFFAOYSA-N
Synonyms
351498-48-1
351498481
CCN1C2=CC=CC=C2C3=C(C1(C)C)SC(=CC34SC=C(S4)C(=O)OCC)C(=O)OCC
diethyl6ethyl55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
diethyl6ethyl55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL6ETHYL55DIMETHYL56DIHYDROSPIRO(1HTHIOPYRANO(23C)QUINOLINE12(13)DITHIOLE)34DICARBOXYLATE
DIETHYL6ETHYL55DIMETHYLSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
InChI=1SC24H27NO4S3c162516121091115(16)1920(23(254)5)3117(21(26)2872)1324(19)301418(3224)22(27)2983h914H68H215H3
MFCD01363167
ZINC000002060898
ZINC000002060899

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Available files

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