Vitas-M small molecule compound
tetramethyl 9'-ethoxy-5',5'-dimethyl-6'-(thiophen-2-ylcarbonyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK133575
SMILES CCOc1ccc2c(c1)C1=C(C(N2C(=O)c2cccs2)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
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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 C31H29NO10S4 MW 703.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO10S4/c1-8-42-15-11-12-17-16(14-15)19-24(30(2,3)32(17)25(33)18-10-9-13-43-18)44-21(27(35)39-5)20(26(34)38-4)31(19)45-22(28(36)40-6)23(46-31)29(37)41-7/h9-14H,8H2,1-7H3InChIKey
XUJZOUZNVAAMGE-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)C5=CC=CS5
InChI=1SC31H29NO10S4c18421511121716(1415)1924(30(23)32(17)25(33)18109134318)4421(27(35)395)20(26(34)384)31(19)4522(28(36)406)23(4631)29(37)417h914H8H217H3
MFCD01363321
tetramethyl9ethoxy55dimethyl6(thiophen2ylcarbonyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethoxy55dimethyl6(thiophene2carbonyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethoxy55dimethyl6(thiophene2carbonyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097999483
ZINC97999483
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