Vitas-M small molecule compound
tetramethyl 6'-(biphenyl-4-ylcarbonyl)-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
STK053738
SMILES CCOc1cccc2c1N(C(=O)c1ccc(cc1)c1ccccc1)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 C39H35NO10S3 MW 773.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H35NO10S3/c1-8-50-25-16-12-15-24-26-32(38(2,3)40(28(24)25)33(41)23-19-17-22(18-20-23)21-13-10-9-11-14-21)51-29(35(43)47-5)27(34(42)46-4)39(26)52-30(36(44)48-6)31(53-39)37(45)49-7/h9-20H,8H2,1-7H3InChIKey
IEBYVMJLACFWNV-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=CC=C(C=C5)C6=CC=CC=C6
CCOc1cccc2c1N(C(=O)c1ccc(cc1)c1ccccc1)C(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)C
InChI=1SC39H35NO10S3c185025161215242632(38(23)40(28(24)25)33(41)23191722(182023)2113109111421)5129(35(43)475)27(34(42)464)39(26)5230(36(44)486)31(5339)37(45)497h920H8H217H3
MFCD01561690
STK053738
tetramethyl6((11biphenyl)4carbonyl)7ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6(biphenyl4ylcarbonyl)7ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl7ethoxy55dimethyl6(4phenylbenzoyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150356255
ZINC150356255
Check stock
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Check stock on Vitas-MAvailable files
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