Vitas-M small molecule compound
3-{5-[(E)-(2-{(2E)-2-{[(2-chlorophenyl)carbonyl]amino}-3-[4-(dimethylamino)phenyl]prop-2-enoyl}hydrazinylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STK330137
SMILES CN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1ccc(o1)c1cccc(c1)C(=O)O)/NC(=O)c1ccccc1Cl)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 C30H25ClN4O5 MW 557.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN4O5/c1-35(2)22-12-10-19(11-13-22)16-26(33-28(36)24-8-3-4-9-25(24)31)29(37)34-32-18-23-14-15-27(40-23)20-6-5-7-21(17-20)30(38)39/h3-18H,1-2H3,(H,33,36)(H,34,37)(H,38,39)/b26-16+,32-18+InChIKey
JDFQFYICPCNTCE-BSPRSFFTSA-NSynonyms
3(5((E)(((E)2((2chlorobenzoyl)amino)3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)furan2yl)benzoicacid
3(5((E)(2((2E)2(((2chlorophenyl)carbonyl)amino)3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)furan2yl)benzoicacid
CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)O)NC(=O)C4=CC=CC=C4Cl
CN(c1ccc(cc1)C=C(C(=O)NN=Cc1ccc(o1)c1cccc(c1)C(=O)O)NC(=O)c1ccccc1Cl)C
InChI=1SC30H25ClN4O5c135(2)22121019(111322)1626(3328(36)24834925(24)31)29(37)34321823141527(4023)2065721(1720)30(38)39h318H12H3(H3336)(H3437)(H3839)b2616+3218+
MFCD01147797
ZINC000097965522
ZINC102035475
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