Vitas-M small molecule compound

ethyl 4-{5-[(E)-(2-{[4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)phenyl]carbonyl}hydrazinylidene)methyl]furan-2-yl}benzoate

Catalog ID
STK364577
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=N/NC(=O)c1ccc(cc1)CN1CCc2c(C1)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 C31H29N3O4 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O4/c1-2-37-31(36)26-13-11-24(12-14-26)29-16-15-28(38-29)19-32-33-30(35)25-9-7-22(8-10-25)20-34-18-17-23-5-3-4-6-27(23)21-34/h3-16,19H,2,17-18,20-21H2,1H3,(H,33,35)/b32-19+
InChIKey
UXAYTIVXMSLEJO-BIZUNTBRSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=NNC(=O)c1ccc(cc1)CN1CCc2c(C1)cccc2
ethyl4(5((E)((4(34dihydro1Hisoquinolin2ylmethyl)benzoyl)hydrazinylidene)methyl)furan2yl)benzoate
ETHYL4(5((E)(2((4(34DIHYDROISOQUINOLIN2(1H)YLMETHYL)PHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC31H29N3O4c123731(36)26131124(121426)29161528(3829)19323330(35)259722(81025)2034181723534627(23)2134h31619H217182021H21H3(H3335)b3219+
MFCD01874630
ZINC000023382827
ZINC34721969

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.