Vitas-M small molecule compound
tetramethyl 2'-methoxy-7',7'-dimethyl-4',5'-dioxo-4',5'-dihydro-7'H-spiro[1,3-dithiole-2,11'-pyrrolo[3,2,1-ij]thiopyrano[2,3-c]quinoline]-4,5,9',10'-tetracarboxylate
Catalog ID
STK032300
SMILES COc1cc2C(=O)C(=O)N3c2c(c1)C1=C(C3(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 C27H23NO11S3 MW 633.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO11S3/c1-26(2)20-13(11-8-10(35-3)9-12-15(11)28(26)21(30)16(12)29)27(14(22(31)36-4)17(40-20)23(32)37-5)41-18(24(33)38-6)19(42-27)25(34)39-7/h8-9H,1-7H3InChIKey
IWBNYGGPYWFLCB-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=CC(=CC4=C3N1C(=O)C4=O)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COc1cc2C(=O)C(=O)N3c2c(c1)C1=C(C3(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC27H23NO11S3c126(2)2013(11810(353)91215(11)28(26)21(30)16(12)29)27(14(22(31)364)17(4020)23(32)375)4118(24(33)386)19(4227)25(34)397h89H17H3
MFCD03301835
STK032300
tetramethyl2methoxy77dimethyl45dioxo45dihydro7Hspiro(13dithiole211pyrrolo(321ij)thiopyrano(23c)quinoline)45910tetracarboxylate
tetramethyl2methoxy77dimethyl45dioxo57dihydro4Hspiro((13)dithiole211pyrrolo(321ij)thiopyrano(23c)quinoline)45910tetracarboxylate
ZINC000150347291
ZINC150347291
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.