Vitas-M small molecule compound
N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-{(2E)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Catalog ID
STK803339
SMILES COc1ccc2c(c1/C=N/NC(=O)/C(=C\c1ccc3c(c1)OCO3)/NC(=O)c1ccccc1)cccc2
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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 C29H23N3O5 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O5/c1-35-25-14-12-20-7-5-6-10-22(20)23(25)17-30-32-29(34)24(31-28(33)21-8-3-2-4-9-21)15-19-11-13-26-27(16-19)37-18-36-26/h2-17H,18H2,1H3,(H,31,33)(H,32,34)/b24-15+,30-17+InChIKey
KANJPRBGNNAAJC-QDWCBANGSA-NSynonyms
COC1=C(C2=CC=CC=C2C=C1)C=NNC(=O)C(=CC3=CC4=C(C=C3)OCO4)NC(=O)C5=CC=CC=C5
COc1ccc2c(c1C=NNC(=O)C(=Cc1ccc3c(c1)OCO3)NC(=O)c1ccccc1)cccc2
InChI=1SC29H23N3O5c135251412207561022(20)23(25)17303229(34)24(3128(33)218324921)151911132627(1619)37183626h217H18H21H3(H3133)(H3234)b2415+3017+
MFCD01146918
N((1E)1(13benzodioxol5yl)3((2E)2((2methoxynaphthalen1yl)methylidene)hydrazinyl)3oxoprop1en2yl)benzamide
N((E)1(13BENZODIOXOL5YL)3((2E)2((2METHOXYNAPHTHALEN1YL)METHYLIDENE)HYDRAZINYL)3OXOPROP1EN2YL)BENZAMIDE
ZINC000022077442
ZINC33403362
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