Vitas-M small molecule compound
N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-(4-methylbenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Catalog ID
STK513839
SMILES Cc1ccc(cc1)/C=N/NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1
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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 C25H21N3O4 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4/c1-17-7-9-18(10-8-17)15-26-28-25(30)21(27-24(29)20-5-3-2-4-6-20)13-19-11-12-22-23(14-19)32-16-31-22/h2-15H,16H2,1H3,(H,27,29)(H,28,30)/b21-13+,26-15+InChIKey
BQTWENDBERFBBX-YXNRUMOYSA-NSynonyms
CC1=CC=C(C=C1)C=NNC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4
Cc1ccc(cc1)C=NNC(=O)C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1
InChI=1SC25H21N3O4c1177918(10817)15262825(30)21(2724(29)205324620)131911122223(1419)32163122h215H16H21H3(H2729)(H2830)b2113+2615+
MFCD13370491
N((1E)1(13benzodioxol5yl)3((2E)2(4methylbenzylidene)hydrazinyl)3oxoprop1en2yl)benzamide
N((E)1(13benzodioxol5yl)3((2E)2((4methylphenyl)methylidene)hydrazinyl)3oxoprop1en2yl)benzamide
ZINC000036235325
ZINC98021027
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