Vitas-M small molecule compound
tetramethyl 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
STK071895
SMILES COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2cccc3c2N(C1(C)C)C(=O)C3=O)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 C26H21NO10S3 MW 603.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO10S3/c1-25(2)19-12(10-8-7-9-11-14(10)27(25)20(29)15(11)28)26(13(21(30)34-3)16(38-19)22(31)35-4)39-17(23(32)36-5)18(40-26)24(33)37-6/h7-9H,1-6H3InChIKey
SMLMQTLMNUDCMH-UHFFFAOYSA-NSynonyms
CC1(C2=C(C3=C4N1C(=O)C(=O)C4=CC=C3)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2cccc3c2N(C1(C)C)C(=O)C3=O)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC26H21NO10S3c125(2)1912(108791114(10)27(25)20(29)15(11)28)26(13(21(30)343)16(3819)22(31)354)3917(23(32)365)18(4026)24(33)376h79H16H3
MFCD03287451
STK071895
tetramethyl77dimethyl45dioxo45dihydro7Hspiro(13dithiole211pyrrolo(321ij)thiopyrano(23c)quinoline)45910tetracarboxylate
tetramethyl77dimethyl45dioxo57dihydro4Hspiro((13)dithiole211pyrrolo(321ij)thiopyrano(23c)quinoline)45910tetracarboxylate
ZINC000100116876
ZINC100116876
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Check stock on Vitas-MAvailable files
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