Vitas-M small molecule compound
3'-ethyl 4,5-dimethyl 7'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4,5-tricarboxylate
Catalog ID
STK130701
SMILES CCOC(=O)C1=CC2(C3=C(S1)C(C)(C)Nc1c3cccc1OCC)SC(=C(S2)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 C25H27NO7S3 MW 549.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO7S3/c1-7-32-14-11-9-10-13-16-20(24(3,4)26-17(13)14)34-15(21(27)33-8-2)12-25(16)35-18(22(28)30-5)19(36-25)23(29)31-6/h9-12,26H,7-8H2,1-6H3InChIKey
AWVVFTNLLBQNHF-UHFFFAOYSA-NSynonyms
3ETHYL45DIMETHYL7ETHOXY55DIMETHYL56DIHYDROSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)345TRICARBOXYLATE
3OETHYL4O5ODIMETHYL7ETHOXY55DIMETHYLSPIRO(13DITHIOLE216HTHIOPYRANO(23C)QUINOLINE)345TRICARBOXYLATE
CCOC1=CC=CC2=C1NC(C3=C2C4(C=C(S3)C(=O)OCC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C
InChI=1SC25H27NO7S3c17321411910131620(24(34)2617(13)14)3415(21(27)3382)1225(16)3518(22(28)305)19(3625)23(29)316h91226H78H216H3
MFCD03903978
ZINC000005949472
ZINC5949472
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