Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-chlorobenzyl)oxy]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK548862
SMILES Clc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

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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 C26H22ClN9O3 MW 543.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN9O3/c27-19-11-9-17(10-12-19)16-38-21-8-4-5-18(13-21)14-30-32-26(37)23-22(15-29-20-6-2-1-3-7-20)36(35-31-23)25-24(28)33-39-34-25/h1-14,29H,15-16H2,(H2,28,33)(H,32,37)/b30-14+
InChIKey
YVJQEUFITASMIQ-AMVVHIIESA-N
Synonyms
799776-63-9
(E)1(4amino125oxadiazol3yl)N(3((4chlorobenzyl)oxy)benzylidene)5((phenylamino)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(ANILINOMETHYL)N((E)(3((4CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
1(4amino125oxadiazol3yl)N((E)(3((4chlorobenzyl)oxy)phenyl)methylidene)5((phenylamino)methyl)1H123triazole4carbohydrazide
799776639
C1=CC=C(C=C1)NCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)OCC5=CC=C(C=C5)Cl
Clc1ccc(cc1)COc1cccc(c1)C=NNC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N
InChI=1SC26H22ClN9O3c271911917(101219)16382184518(1321)14303226(37)2322(1529206213720)36(353123)2524(28)33393425h11429H1516H2(H22833)(H3237)b3014+
MFCD03339854
ZINC000002207479
ZINC102451871

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Available files

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