Vitas-M small molecule compound
tetramethyl 5',5',7',9'-tetramethyl-6'-(2-oxo-2-phenylethyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK047095
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1C)CC(=O)c1ccccc1)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 C34H33NO9S3 MW 695.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33NO9S3/c1-17-14-18(2)24-20(15-17)22-28(33(3,4)35(24)16-21(36)19-12-10-9-11-13-19)45-25(30(38)42-6)23(29(37)41-5)34(22)46-26(31(39)43-7)27(47-34)32(40)44-8/h9-15H,16H2,1-8H3InChIKey
HTGUSRGBAUESPT-UHFFFAOYSA-NSynonyms
CC1=CC(=C2C(=C1)C3=C(C(N2CC(=O)C4=CC=CC=C4)(C)C)SC(=C(C35SC(=C(S5)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1C)CC(=O)c1ccccc1)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC34H33NO9S3c1171418(2)2420(1517)2228(33(34)35(24)1621(36)1912109111319)4525(30(38)426)23(29(37)415)34(22)4626(31(39)437)27(4734)32(40)448h915H16H218H3
MFCD01859168
STK047095
tetramethyl5579tetramethyl6(2oxo2phenylethyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl5579tetramethyl6(2oxo2phenylethyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl5579tetramethyl6phenacylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150358472
ZINC150358472
Check stock
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Check stock on Vitas-MAvailable files
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