Vitas-M small molecule compound
tetramethyl 6'-[(3,4-dichlorophenyl)carbamoyl]-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK508744
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(OC)cc1)C(=O)Nc1ccc(c(c1)Cl)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 C32H28Cl2N2O10S3 MW 767.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28Cl2N2O10S3/c1-31(2)25-20(16-13-15(42-3)9-11-19(16)36(31)30(41)35-14-8-10-17(33)18(34)12-14)32(21(26(37)43-4)22(47-25)27(38)44-5)48-23(28(39)45-6)24(49-32)29(40)46-7/h8-13H,1-7H3,(H,35,41)InChIKey
MXARCKCWFKBCJS-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C(N1C(=O)NC4=CC(=C(C=C4)Cl)Cl)C=CC(=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
InChI=1SC32H28Cl2N2O10S3c131(2)2520(161315(423)91119(16)36(31)30(41)351481017(33)18(34)1214)32(21(26(37)434)22(4725)27(38)445)4823(28(39)456)24(4932)29(40)467h813H17H3(H3541)
MFCD02127811
tetramethyl6((34dichlorophenyl)carbamoyl)9methoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6((34dichlorophenyl)carbamoyl)9methoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6((34dichlorophenyl)carbamoyl)9methoxy55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150442467
ZINC150442467
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.