Vitas-M small molecule compound

N'-[(Z)-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}methylidene]-1,3-benzodioxole-5-carbohydrazide

Catalog ID
STK452929
SMILES COc1ccc(cc1COc1ccc(cc1)I)/C=N\NC(=O)c1ccc2c(c1)OCO2

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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 C23H19IN2O5 MW 530.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19IN2O5/c1-28-20-8-2-15(10-17(20)13-29-19-6-4-18(24)5-7-19)12-25-26-23(27)16-3-9-21-22(11-16)31-14-30-21/h2-12H,13-14H2,1H3,(H,26,27)/b25-12-
InChIKey
UXGMJVFCYYNKHL-ROTLSHHCSA-N
Synonyms

2HBENZO(34D)13DIOXOLAN5YLN((1Z)2(3((4IODOPHENOXY)METHYL)4METHOXYPHENYL)1AZAVINYL)CARBOXAMIDE
COC1=C(C=C(C=C1)C=NNC(=O)C2=CC3=C(C=C2)OCO3)COC4=CC=C(C=C4)I
COc1ccc(cc1COc1ccc(cc1)I)C=NNC(=O)c1ccc2c(c1)OCO2
InChI=1SC23H19IN2O5c128208215(1017(20)1329196418(24)5719)12252623(27)16392122(1116)31143021h212H1314H21H3(H2627)b2512
MFCD02372609
N((Z)(3((4iodophenoxy)methyl)4methoxyphenyl)methylidene)13benzodioxole5carbohydrazide
N((Z)(3((4IODOPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENEAMINO)13BENZODIOXOLE5CARBOXAMIDE
N(3((4IODOPHENOXY)METHYL)4METHOXYBENZYLIDENE)13BENZODIOXOLE5CARBOHYDRAZIDE
ZINC000097944466
ZINC102304888

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Available files

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