Vitas-M small molecule compound

diethyl 9'-ethoxy-5',5'-dimethyl-6'-(3-methylbutanoyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate

Catalog ID
STK508654
SMILES CCOc1ccc2c(c1)C1=C(C(N2C(=O)CC(C)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 C29H35NO6S3 MW 589.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO6S3/c1-8-34-18-11-12-20-19(14-18)24-25(28(6,7)30(20)23(31)13-17(4)5)38-21(26(32)35-9-2)15-29(24)37-16-22(39-29)27(33)36-10-3/h11-12,14-17H,8-10,13H2,1-7H3
InChIKey
YIELVSFINQNOBT-UHFFFAOYSA-N
Synonyms

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)CC(C)C
diethyl9ethoxy55dimethyl6(3methylbutanoyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
diethyl9ethoxy55dimethyl6(3methylbutanoyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL9ETHOXY55DIMETHYL6(3METHYLBUTANOYL)SPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
InChI=1SC29H35NO6S3c18341811122019(1418)2425(28(67)30(20)23(31)1317(4)5)3821(26(32)3592)1529(24)371622(3929)27(33)36103h11121417H81013H217H3
MFCD01558671
ZINC000001886582
ZINC000001886585

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Available files

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