Vitas-M small molecule compound
tetramethyl 6'-[(2-bromophenyl)carbonyl]-5',5',7'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK300104
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cccc1C)C(=O)c1ccccc1Br)SC(=C(S2)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 C32H28BrNO9S3 MW 746.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28BrNO9S3/c1-15-11-10-13-17-19-25(31(2,3)34(21(15)17)26(35)16-12-8-9-14-18(16)33)44-22(28(37)41-5)20(27(36)40-4)32(19)45-23(29(38)42-6)24(46-32)30(39)43-7/h8-14H,1-7H3InChIKey
FGBBCZJUHFEIBA-UHFFFAOYSA-NSynonyms
CC1=CC=CC2=C1N(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=CC=C5Br
InChI=1SC32H28BrNO9S3c115111013171925(31(23)34(21(15)17)26(35)1612891418(16)33)4422(28(37)415)20(27(36)404)32(19)4523(29(38)426)24(4632)30(39)437h814H17H3
MFCD01564358
tetramethyl6((2bromophenyl)carbonyl)557trimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2bromobenzoyl)557trimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2bromobenzoyl)557trimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097999910
ZINC97999910
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