Vitas-M small molecule compound
dimethyl 5-({[4-chloro-3-({3-[2-(octadecyloxy)phenyl]-3-oxopropanoyl}amino)phenyl]sulfonyl}amino)benzene-1,3-dicarboxylate
Catalog ID
STK366116
SMILES CCCCCCCCCCCCCCCCCCOc1ccccc1C(=O)CC(=O)Nc1cc(ccc1Cl)S(=O)(=O)Nc1cc(cc(c1)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 C43H57ClN2O9S MW 813.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H57ClN2O9S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26-55-40-23-20-19-22-36(40)39(47)31-41(48)45-38-30-35(24-25-37(38)44)56(51,52)46-34-28-32(42(49)53-2)27-33(29-34)43(50)54-3/h19-20,22-25,27-30,46H,4-18,21,26,31H2,1-3H3,(H,45,48)InChIKey
IUUYVCOGLVYYOX-UHFFFAOYSA-NSynonyms
CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)Cl
dimethyl5(((4chloro3((3(2(octadecyloxy)phenyl)3oxopropanoyl)amino)phenyl)sulfonyl)amino)benzene13dicarboxylate
DIMETHYL5((4CHLORO3((3(2OCTADECOXYPHENYL)3OXOPROPANOYL)AMINO)PHENYL)SULFONYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC43H57ClN2O9Sc1456789101112131415161718212655402320192236(40)39(47)3141(48)45383035(242537(38)44)56(5152)46342832(42(49)532)2733(2934)43(50)543h19202225273046H418212631H213H3(H4548)
METHYL5(((4CHLORO3(3(2OCTADECYLOXYPHENYL)3OXOPROPANOYLAMINO)PHENYL)SULFONYL)AMINO)3(METHOXYCARBONYL)BENZOATE
MFCD00308224
ZINC000150390441
ZINC150390441
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