Vitas-M small molecule compound

(5-chloro-2-methoxyphenyl)({[(Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methylidene]amino}oxy)methanone

Catalog ID
STK627671
SMILES COc1cc(ccc1OC)/C(=N/OC(=O)c1cc(Cl)ccc1OC)/c1nccc2c1cc(OC)c(c2)OC

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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 C28H25ClN2O7 MW 536.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN2O7/c1-33-21-9-7-18(29)14-20(21)28(32)38-31-26(17-6-8-22(34-2)23(13-17)35-3)27-19-15-25(37-5)24(36-4)12-16(19)10-11-30-27/h6-15H,1-5H3/b31-26-
InChIKey
WILVQFCUHPHQLI-ZXPTYKNPSA-N
Synonyms
892616-71-6
((Z)((67DIMETHOXYISOQUINOLIN1YL)(34DIMETHOXYPHENYL)METHYLIDENE)AMINO)5CHLORO2METHOXYBENZOATE
(5chloro2methoxyphenyl)((((Z)(67dimethoxyisoquinolin1yl)(34dimethoxyphenyl)methylidene)amino)oxy)methanone
(Z)(67dimethoxyisoquinolin1yl)(34dimethoxyphenyl)methanoneO(5chloro2methoxybenzoyl)oxime
892616716
COC1=C(C=C(C=C1)Cl)C(=O)ON=C(C2=CC(=C(C=C2)OC)OC)C3=NC=CC4=CC(=C(C=C43)OC)OC
COc1cc(ccc1OC)C(=NOC(=O)c1cc(Cl)ccc1OC)c1nccc2c1cc(OC)c(c2)OC
InChI=1SC28H25ClN2O7c133219718(29)1420(21)28(32)383126(176822(342)23(1317)353)27191525(375)24(364)1216(19)10113027h615H15H3b3126
MFCD03660031
ZINC000101297522
ZINC102734875

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Available files

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