Vitas-M small molecule compound
diethyl 7'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',4-dicarboxylate
Catalog ID
STK789918
SMILES CCOC(=O)C1=CSC2=C(C31SC=C(S3)C(=O)OCC)c1cccc(c1NC2(C)C)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 C24H27NO5S3 MW 505.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5S3/c1-6-28-16-11-9-10-14-18-20(23(4,5)25-19(14)16)31-12-15(21(26)29-7-2)24(18)32-13-17(33-24)22(27)30-8-3/h9-13,25H,6-8H2,1-5H3InChIKey
UUUZYGYBLBLDSS-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC2=C1NC(C3=C2C4(C(=CS3)C(=O)OCC)SC=C(S4)C(=O)OCC)(C)C
diethyl7ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)24dicarboxylate
diethyl7ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)24dicarboxylate
DIETHYL7ETHOXY55DIMETHYLSPIRO(13DITHIOLE216HTHIOPYRANO(23C)QUINOLINE)24DICARBOXYLATE
InChI=1SC24H27NO5S3c16281611910141820(23(45)2519(14)16)311215(21(26)2972)24(18)321317(3324)22(27)3083h91325H68H215H3
MFCD02127781
ZINC000001070446
ZINC000001070447
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