Vitas-M small molecule compound

N'-[(E)-{3-chloro-5-methoxy-4-[(3-methylbenzyl)oxy]phenyl}methylidene]naphtho[2,1-b]furan-2-carbohydrazide

Catalog ID
STK026627
SMILES COc1cc(/C=N/NC(=O)c2oc3c(c2)c2ccccc2cc3)cc(c1OCc1cccc(c1)C)Cl

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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 C29H23ClN2O4 MW 498.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClN2O4/c1-18-6-5-7-19(12-18)17-35-28-24(30)13-20(14-26(28)34-2)16-31-32-29(33)27-15-23-22-9-4-3-8-21(22)10-11-25(23)36-27/h3-16H,17H2,1-2H3,(H,32,33)/b31-16+
InChIKey
VLFCWGOHBGBPDA-WCMJOSRZSA-N
Synonyms

CC1=CC(=CC=C1)COC2=C(C=C(C=C2Cl)C=NNC(=O)C3=CC4=C(O3)C=CC5=CC=CC=C54)OC
COc1cc(C=NNC(=O)c2oc3c(c2)c2ccccc2cc3)cc(c1OCc1cccc(c1)C)Cl
InChI=1SC29H23ClN2O4c11865719(1218)17352824(30)1320(1426(28)342)16313229(33)27152322943821(22)101125(23)3627h316H17H212H3(H3233)b3116+
MFCD03082228
N((E)(3CHLORO5METHOXY4((3METHYLBENZYL)OXY)PHENYL)METHYLIDENE)NAPHTHO(21B)FURAN2CARBOHYDRAZIDE
N((E)(3CHLORO5METHOXY4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)BENZO(E)(1)BENZOFURAN2CARBOXAMIDE
N(3CHLORO5METHOXY4((3METHYLBENZYL)OXY)BENZYLIDENE)NAPHTHO(21B)FURAN2CARBOHYDRAZIDE
STK026627
ZINC000002162518
ZINC101409964

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Available files

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