Vitas-M small molecule compound

2,2'-(E)-ethene-1,2-diylbis[5-({4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]

Catalog ID
STK370468
SMILES CC1(C)CC(Nc2nc(Nc3ccc(c(c3)S(=O)(=O)[O-])/C=C/c3ccc(cc3S(=O)(=O)[O-])Nc3nc(NC4CC(C)(C)NC(C4)(C)C)nc(n3)NC3CC(C)(C)NC(C3)(C)C)nc(n2)NC2CC(C)(C)NC(C2)(C)C)CC(N1)(C)C

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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 C56H86N16O6S2 MW 1143.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C56H88N16O6S2/c1-49(2)25-37(26-50(3,4)69-49)59-45-63-43(64-46(67-45)60-38-27-51(5,6)70-52(7,8)28-38)57-35-21-19-33(41(23-35)79(73,74)75)17-18-34-20-22-36(24-42(34)80(76,77)78)58-44-65-47(61-39-29-53(9,10)71-54(11,12)30-39)68-48(66-44)62-40-31-55(
InChIKey
OZODYXPWMILKHV-ISLYRVAYSA-L
Synonyms

22(E)ethene12diylbis(5((46bis((2266tetramethylpiperidin4yl)amino)135triazin2yl)amino)benzenesulfonate)
5((46bis((2266tetramethylpiperidin4yl)amino)135triazin2yl)amino)2((E)2(4((46bis((2266tetramethylpiperidin4yl)amino)135triazin2yl)amino)2sulfonatophenyl)ethenyl)benzenesulfonate
CC1(C)CC(Nc2nc(Nc3ccc(c(c3)S(=O)(=O)(O))C=Cc3ccc(cc3S(=O)(=O)(O))Nc3nc(NC4CC(C)(C)NC(C4)(C)C)nc(n3)NC3CC(C)(C)NC(C3)(C)C)nc(n2)NC2CC(C)(C)NC(C2)(C)C)CC(N1)(C)C
CC1(CC(CC(N1)(C)C)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6CC(NC(C6)(C)C)(C)C)NC7CC(NC(C7)(C)C)(C)C)S(=O)(=O)(O))S(=O)(=O)(O))NC8CC(NC(C8)(C)C)(C)C)C
InChI=1SC56H88N16O6S2c149(2)2537(2650(34)6949)59456343(6446(6745)60382751(56)7052(78)2838)5735211933(41(2335)79(7374)75)171834202236(2442(34)80(7677)78)58446547(61392953(910)7154(1112)3039)6848(6644)62403155(1314)7256(1516)3240h172437406972H2532H2116
MFCD00309128

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Available files

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