Vitas-M small molecule compound

diethyl 9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate

Catalog ID
STK871128
SMILES CCOC(=O)C1=CSC2(S1)C=C(SC1=C2c2cc(OC)ccc2NC1(C)C)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 C23H25NO5S3 MW 491.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5S3/c1-6-28-20(25)16-11-23(30-12-17(32-23)21(26)29-7-2)18-14-10-13(27-5)8-9-15(14)24-22(3,4)19(18)31-16/h8-12,24H,6-7H2,1-5H3
InChIKey
KNLVKQKCBXOMCE-UHFFFAOYSA-N
Synonyms
352445-37-5
352445375
CCOC(=O)C1=CC2(C3=C(S1)C(NC4=C3C=C(C=C4)OC)(C)C)SC=C(S2)C(=O)OCC
DIETHYL(2S)9METHOXY55DIMETHYL56DIHYDROSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
diethyl9methoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL9METHOXY55DIMETHYL56DIHYDROSPIRO(13DITHIOLE21(1H)THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
diethyl9methoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL9METHOXY55DIMETHYLSPIRO(13DITHIOLE216HTHIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
InChI=1SC23H25NO5S3c162820(25)161123(301217(3223)21(26)2972)18141013(275)8915(14)2422(34)19(18)3116h81224H67H215H3
MFCD01363162
ZINC000002060874
ZINC000002060875

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Available files

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