Vitas-M small molecule compound
3-[({1-hydroxy-4-[(E)-(2-methyl-4-{[(4-methylphenyl)sulfonyl]amino}phenyl)diazenyl]naphthalen-2-yl}carbonyl)amino]-4-(octadecylamino)benzoic acid
Catalog ID
STK382987
SMILES CCCCCCCCCCCCCCCCCCNc1ccc(cc1NC(=O)c1cc(/N=N/c2ccc(cc2C)NS(=O)(=O)c2ccc(cc2)C)c2c(c1O)cccc2)C(=O)O
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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 C50H63N5O6S MW 862.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C50H63N5O6S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-32-51-45-30-26-38(50(58)59)34-47(45)52-49(57)43-35-46(41-22-19-20-23-42(41)48(43)56)54-53-44-31-27-39(33-37(44)3)55-62(60,61)40-28-24-36(2)25-29-40/h19-20,22-31,33-35,51,55-56H,4-18,21,32H2InChIKey
MJKDKTBJACUMKI-DBFBYELTSA-NSynonyms
3(((1hydroxy4((E)(2methyl4(((4methylphenyl)sulfonyl)amino)phenyl)diazenyl)naphthalen2yl)carbonyl)amino)4(octadecylamino)benzoicacid
CCCCCCCCCCCCCCCCCCNc1ccc(cc1NC(=O)c1cc(N=Nc2ccc(cc2C)NS(=O)(=O)c2ccc(cc2)C)c2c(c1O)cccc2)C(=O)O
MFCD03037461
ZINC000097963975
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