Vitas-M small molecule compound
trimethyl 2,2',2''-{1,3,5-triazine-2,4,6-triyltris[sulfanediyl(1-oxoethane-2,1-diyl)imino]}tribenzoate
Catalog ID
STK733342
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc(SCC(=O)Nc2ccccc2C(=O)OC)nc(n1)SCC(=O)Nc1ccccc1C(=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 C33H30N6O9S3 MW 750.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N6O9S3/c1-46-28(43)19-10-4-7-13-22(19)34-25(40)16-49-31-37-32(50-17-26(41)35-23-14-8-5-11-20(23)29(44)47-2)39-33(38-31)51-18-27(42)36-24-15-9-6-12-21(24)30(45)48-3/h4-15H,16-18H2,1-3H3,(H,34,40)(H,35,41)(H,36,42)InChIKey
RQNPATDQLCFQNB-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=NC(=N2)SCC(=O)NC3=CC=CC=C3C(=O)OC)SCC(=O)NC4=CC=CC=C4C(=O)OC
InChI=1SC33H30N6O9S3c14628(43)1910471322(19)3425(40)1649313732(501726(41)352314851120(23)29(44)472)3933(3831)511827(42)362415961221(24)30(45)483h415H1618H213H3(H3440)(H3541)(H3642)
METHYL2((2((46BIS((2(2METHOXYCARBONYLANILINO)2OXOETHYL)SULFANYL)135TRIAZIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD00843535
trimethyl222((222((135triazine246triyl)tris(sulfanediyl))tris(acetyl))tris(azanediyl))tribenzoate
trimethyl222(135triazine246triyltris(sulfanediyl(1oxoethane21diyl)imino))tribenzoate
ZINC000150385524
ZINC150385524
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.