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tetramethyl 5',5',9'-trimethyl-6'-(thiophen-2-ylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Catalog ID
STK006571
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1cccs1)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 C31H29NO9S4 MW 687.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO9S4/c1-15-10-11-18-17(13-15)20-25(30(2,3)32(18)19(33)14-16-9-8-12-42-16)43-22(27(35)39-5)21(26(34)38-4)31(20)44-23(28(36)40-6)24(45-31)29(37)41-7/h8-13H,14H2,1-7H3
InChIKey
USRLECZHXMITRL-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)CC5=CC=CS5
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1cccs1)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC31H29NO9S4c11510111817(1315)2025(30(23)32(18)19(33)141698124216)4322(27(35)395)21(26(34)384)31(20)4423(28(36)406)24(4531)29(37)417h813H14H217H3
MFCD03190481
STK006571
tetramethyl559trimethyl6(2(thiophen2yl)acetyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl559trimethyl6(2thiophen2ylacetyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl559trimethyl6(thiophen2ylacetyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150393158
ZINC150393158

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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