Vitas-M small molecule compound
2,2'-(E)-ethene-1,2-diylbis(5-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]amino}benzenesulfonate)
Catalog ID
STK367897
SMILES [O-]S(=O)(=O)c1cc(ccc1/C=C/c1ccc(cc1S(=O)(=O)[O-])Nc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1)Nc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
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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 C44H34N12O6S2 MW 890.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H36N12O6S2/c57-63(58,59)37-27-35(49-43-53-39(45-31-13-5-1-6-14-31)51-40(54-43)46-32-15-7-2-8-16-32)25-23-29(37)21-22-30-24-26-36(28-38(30)64(60,61)62)50-44-55-41(47-33-17-9-3-10-18-33)52-42(56-44)48-34-19-11-4-12-20-34/h1-28H,(H,57,58,59)(H,60InChIKey
HRHCYUBSBRXMIN-QURGRASLSA-LSynonyms
(O)S(=O)(=O)c1cc(ccc1C=Cc1ccc(cc1S(=O)(=O)(O))Nc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1)Nc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
22(E)ethene12diylbis(5((46bis(phenylamino)135triazin2yl)amino)benzenesulfonate)
5((46DIANILINO135TRIAZIN2YL)AMINO)2((E)2(4((46DIANILINO135TRIAZIN2YL)AMINO)2SULFONATOPHENYL)ETHENYL)BENZENESULFONATE
C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NC7=CC=CC=C7)S(=O)(=O)(O))S(=O)(=O)(O))NC8=CC=CC=C8
InChI=1SC44H36N12O6S2c5763(5859)372735(49435339(4531135161431)5140(5443)4632157281632)252329(37)212230242636(2838(30)64(6061)62)50445541(47331793101833)5242(5644)483419114122034h128H(H575859)(H606162)(H3454649515354)(H3474850525556)p2b2221+
MFCD00602536
ZINC000150344591
Check stock
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