Vitas-M small molecule compound
tetramethyl 6'-[(4-chlorophenoxy)acetyl]-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK061681
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cccc1)C(=O)COc1ccc(cc1)Cl)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 C32H28ClNO10S3 MW 718.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28ClNO10S3/c1-31(2)26-21(18-9-7-8-10-19(18)34(31)20(35)15-44-17-13-11-16(33)12-14-17)32(22(27(36)40-3)23(45-26)28(37)41-4)46-24(29(38)42-5)25(47-32)30(39)43-6/h7-14H,15H2,1-6H3InChIKey
JBJNRAIHBCOCIA-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=CC=CC=C3N1C(=O)COC4=CC=C(C=C4)Cl)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cccc1)C(=O)COc1ccc(cc1)Cl)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC32H28ClNO10S3c131(2)2621(189781019(18)34(31)20(35)154417131116(33)121417)32(22(27(36)403)23(4526)28(37)414)4624(29(38)425)25(4732)30(39)436h714H15H216H3
MFCD01565023
STK061681
tetramethyl6((4chlorophenoxy)acetyl)55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(4chlorophenoxy)acetyl)55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(2(4chlorophenoxy)acetyl)55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150361308
ZINC150361308
Check stock
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Check stock on Vitas-MAvailable files
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