Vitas-M small molecule compound
tetramethyl 6'-[(2,4-dichlorophenyl)carbonyl]-7'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK095714
SMILES CCOc1cccc2c1N(C(=O)c1ccc(cc1Cl)Cl)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)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 C33H29Cl2NO10S3 MW 766.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29Cl2NO10S3/c1-8-46-19-11-9-10-17-20-26(32(2,3)36(22(17)19)27(37)16-13-12-15(34)14-18(16)35)47-23(29(39)43-5)21(28(38)42-4)33(20)48-24(30(40)44-6)25(49-33)31(41)45-7/h9-14H,8H2,1-7H3InChIKey
QCFKHYLAGMEGJJ-UHFFFAOYSA-NSynonyms
CCOC1=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=C(C=C(C=C5)Cl)Cl
CCOc1cccc2c1N(C(=O)c1ccc(cc1Cl)Cl)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)C
InChI=1SC33H29Cl2NO10S3c18461911910172026(32(23)36(22(17)19)27(37)16131215(34)1418(16)35)4723(29(39)435)21(28(38)424)33(20)4824(30(40)446)25(4933)31(41)457h914H8H217H3
MFCD01561106
STK095714
tetramethyl6((24dichlorophenyl)carbonyl)7ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(24dichlorobenzoyl)7ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(24dichlorobenzoyl)7ethoxy55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150471915
ZINC150471915
Check stock
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Check stock on Vitas-MAvailable files
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