Vitas-M small molecule compound
diethyl 6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Catalog ID
STK789565
SMILES CCOc1ccc2c(c1)C1=C(C(N2C(=O)C)(C)C)SC(=CC21SC=C(S2)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 C26H29NO6S3 MW 547.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6S3/c1-7-31-16-10-11-18-17(12-16)21-22(25(5,6)27(18)15(4)28)35-19(23(29)32-8-2)13-26(21)34-14-20(36-26)24(30)33-9-3/h10-14H,7-9H2,1-6H3InChIKey
KSNGVPJKGKBPSA-UHFFFAOYSA-NSynonyms
332043-57-9332043579
CCOC1=CC2=C(C=C1)N(C(C3=C2C4(C=C(S3)C(=O)OCC)SC=C(S4)C(=O)OCC)(C)C)C(=O)C
diethyl6acetyl9ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
diethyl6acetyl9ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL6ACETYL9ETHOXY55DIMETHYLSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
InChI=1SC26H29NO6S3c17311610111817(1216)2122(25(56)27(18)15(4)28)3519(23(29)3282)1326(21)341420(3626)24(30)3393h1014H79H216H3
MFCD01363165
ZINC000006631059
ZINC000006631060
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