Vitas-M small molecule compound
tetraethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK016718
SMILES CCOc1ccc2c(c1)C1=C(C(N2)(C)C)SC(=C(C21SC(=C(S2)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC
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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 C30H35NO9S3 MW 649.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO9S3/c1-8-36-16-13-14-18-17(15-16)19-24(29(6,7)31-18)41-21(26(33)38-10-3)20(25(32)37-9-2)30(19)42-22(27(34)39-11-4)23(43-30)28(35)40-12-5/h13-15,31H,8-12H2,1-7H3InChIKey
WGVZXNFRUGNQDM-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)NC(C3=C2C4(C(=C(S3)C(=O)OCC)C(=O)OCC)SC(=C(S4)C(=O)OCC)C(=O)OCC)(C)C
CCOc1ccc2c(c1)C1=C(C(N2)(C)C)SC(=C(C21SC(=C(S2)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC
InChI=1SC30H35NO9S3c18361613141817(1516)1924(29(67)3118)4121(26(33)38103)20(25(32)3792)30(19)4222(27(34)39114)23(4330)28(35)40125h131531H812H217H3
MFCD00532519
STK016718
tetraethyl9ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl9ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl9ethoxy55dimethylspiro(13dithiole216Hthiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008435472
ZINC08435472
ZINC8435472
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.