Vitas-M small molecule compound
tetramethyl 6'-acetyl-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK051876
SMILES COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2ccccc2N(C1(C)C)C(=O)C)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 C26H25NO9S3 MW 591.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO9S3/c1-12(28)27-14-11-9-8-10-13(14)15-20(25(27,2)3)37-17(22(30)34-5)16(21(29)33-4)26(15)38-18(23(31)35-6)19(39-26)24(32)36-7/h8-11H,1-7H3InChIKey
WJBBSOOWJVIZJH-UHFFFAOYSA-NSynonyms
CC(=O)N1C2=CC=CC=C2C3=C(C1(C)C)SC(=C(C34SC(=C(S4)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2ccccc2N(C1(C)C)C(=O)C)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC26H25NO9S3c112(28)271411981013(14)1520(25(272)3)3717(22(30)345)16(21(29)334)26(15)3818(23(31)356)19(3926)24(32)367h811H17H3
MFCD00532492
STK051876
tetramethyl6acetyl55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6acetyl55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6acetyl55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000004091161
ZINC4091161
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Check stock on Vitas-MAvailable files
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