Vitas-M small molecule compound
N-{(1E)-3-[(2E)-2-(3,4-diethoxybenzylidene)hydrazinyl]-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide
Catalog ID
STK513952
SMILES CCOc1cc(/C=N/NC(=O)/C(=C\c2ccc(cc2)N(C)C)/NC(=O)c2ccccc2)ccc1OCC
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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 C29H32N4O4 MW 500.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O4/c1-5-36-26-17-14-22(19-27(26)37-6-2)20-30-32-29(35)25(31-28(34)23-10-8-7-9-11-23)18-21-12-15-24(16-13-21)33(3)4/h7-20H,5-6H2,1-4H3,(H,31,34)(H,32,35)/b25-18+,30-20+InChIKey
HLMOMORMSWCDHU-LBIBGFCHSA-NSynonyms
CCOC1=C(C=C(C=C1)C=NNC(=O)C(=CC2=CC=C(C=C2)N(C)C)NC(=O)C3=CC=CC=C3)OCC
CCOc1cc(C=NNC(=O)C(=Cc2ccc(cc2)N(C)C)NC(=O)c2ccccc2)ccc1OCC
InChI=1SC29H32N4O4c153626171422(1927(26)3762)20303229(35)25(3128(34)23108791123)1821121524(161321)33(3)4h720H56H214H3(H3134)(H3235)b2518+3020+
MFCD01146877
N((1E)3((2E)2(34diethoxybenzylidene)hydrazinyl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
N((E)3((2E)2((34diethoxyphenyl)methylidene)hydrazinyl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
ZINC000036235458
ZINC98021217
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