Vitas-M small molecule compound
tetramethyl 9'-ethoxy-5',5'-dimethyl-6'-(phenylcarbamoyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK078887
SMILES CCOc1ccc2c(c1)C1=C(C(N2C(=O)Nc2ccccc2)(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 C33H32N2O10S3 MW 712.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O10S3/c1-8-45-18-14-15-20-19(16-18)21-26(32(2,3)35(20)31(40)34-17-12-10-9-11-13-17)46-23(28(37)42-5)22(27(36)41-4)33(21)47-24(29(38)43-6)25(48-33)30(39)44-7/h9-16H,8H2,1-7H3,(H,34,40)InChIKey
DDTMEKYOHFQKIQ-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)NC5=CC=CC=C5
CCOc1ccc2c(c1)C1=C(C(N2C(=O)Nc2ccccc2)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC33H32N2O10S3c18451814152019(1618)2126(32(23)35(20)31(40)341712109111317)4623(28(37)425)22(27(36)414)33(21)4724(29(38)436)25(4833)30(39)447h916H8H217H3(H3440)
MFCD02234324
STK078887
tetramethyl9ethoxy55dimethyl6(phenylcarbamoyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethoxy55dimethyl6(phenylcarbamoyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethoxy55dimethyl6(phenylcarbamoyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150419884
ZINC150419884
Check stock
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Check stock on Vitas-MAvailable files
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