Vitas-M small molecule compound

N'-[(E)-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}methylidene]-1-benzothiophene-3-carbohydrazide

Catalog ID
STK453422
SMILES COc1ccc(cc1COc1ccc(cc1)Cl)/C=N/NC(=O)c1csc2c1cccc2

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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 C24H19ClN2O3S MW 450.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O3S/c1-29-22-11-6-16(12-17(22)14-30-19-9-7-18(25)8-10-19)13-26-27-24(28)21-15-31-23-5-3-2-4-20(21)23/h2-13,15H,14H2,1H3,(H,27,28)/b26-13+
InChIKey
WMDMLUXWGNHDNQ-LGJNPRDNSA-N
Synonyms

COC1=C(C=C(C=C1)C=NNC(=O)C2=CSC3=CC=CC=C32)COC4=CC=C(C=C4)Cl
COc1ccc(cc1COc1ccc(cc1)Cl)C=NNC(=O)c1csc2c1cccc2
InChI=1SC24H19ClN2O3Sc1292211616(1217(22)1430199718(25)81019)13262724(28)21153123532420(21)23h21315H14H21H3(H2728)b2613+
MFCD02607662
N((1E)2(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)1AZAVINYL)BENZO(B)THIOPHEN3YLCARBOXAMIDE
N((E)(3((4chlorophenoxy)methyl)4methoxyphenyl)methylidene)1benzothiophene3carbohydrazide
N((E)(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENEAMINO)1BENZOTHIOPHENE3CARBOXAMIDE
N(3((4CHLOROPHENOXY)METHYL)4METHOXYBENZYLIDENE)1BENZOTHIOPHENE3CARBOHYDRAZIDE
ZINC000002103537
ZINC33348553

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Available files

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