Vitas-M small molecule compound
tetramethyl 6'-[(3,5-dimethoxyphenyl)carbonyl]-5',5',8',9'-tetramethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STL361203
SMILES COc1cc(OC)cc(c1)C(=O)N1c2cc(C)c(cc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C
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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 C35H35NO11S3 MW 741.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H35NO11S3/c1-16-11-21-22(12-17(16)2)36(29(37)18-13-19(42-5)15-20(14-18)43-6)34(3,4)28-23(21)35(24(30(38)44-7)25(48-28)31(39)45-8)49-26(32(40)46-9)27(50-35)33(41)47-10/h11-15H,1-10H3InChIKey
DQUUZAWHCKANKF-UHFFFAOYSA-NSynonyms
CC1=C(C=C2C(=C1)C3=C(C(N2C(=O)C4=CC(=CC(=C4)OC)OC)(C)C)SC(=C(C35SC(=C(S5)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C
InChI=1SC35H35NO11S3c116112122(1217(16)2)36(29(37)181319(425)1520(1418)436)34(34)2823(21)35(24(30(38)447)25(4828)31(39)458)4926(32(40)469)27(5035)33(41)4710h1115H110H3
MFCD03297542
tetramethyl6((35dimethoxyphenyl)carbonyl)5589tetramethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(35dimethoxybenzoyl)5589tetramethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097965934
ZINC97965934
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