Vitas-M small molecule compound
tetramethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK004264
SMILES COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1ccccc1)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 C33H31NO9S3 MW 681.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31NO9S3/c1-17-13-14-20-19(15-17)22-27(32(2,3)34(20)21(35)16-18-11-9-8-10-12-18)44-24(29(37)41-5)23(28(36)40-4)33(22)45-25(30(38)42-6)26(46-33)31(39)43-7/h8-15H,16H2,1-7H3InChIKey
ZNXMQEYRPHEVRV-UHFFFAOYSA-NSynonyms
351468-03-6351468036
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=CC=C5
COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1ccccc1)SC(=C(S2)C(=O)OC)C(=O)OC
InChI=1SC33H31NO9S3c11713142019(1517)2227(32(23)34(20)21(35)16181198101218)4424(29(37)415)23(28(36)404)33(22)4525(30(38)426)26(4633)31(39)437h815H16H217H3
MFCD01565583
STK004264
tetramethyl559trimethyl6(2phenylacetyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl559trimethyl6(2phenylacetyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl559trimethyl6(phenylacetyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008443741
ZINC08443741
ZINC8443741
Check stock
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Check stock on Vitas-MAvailable files
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