Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-benzylpiperidin-1-yl)methyl]-N'-[(E)-(4-methylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL347578
SMILES Cc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCC(CC1)Cc1ccccc1)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 C26H29N9O2 MW 499.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N9O2/c1-18-7-9-21(10-8-18)16-28-30-26(36)23-22(35(33-29-23)25-24(27)31-37-32-25)17-34-13-11-20(12-14-34)15-19-5-3-2-4-6-19/h2-10,16,20H,11-15,17H2,1H3,(H2,27,31)(H,30,36)/b28-16+
InChIKey
CWGBMQNIAZNGDV-LQKURTRISA-N
Synonyms
861118-86-7
(E)1(4amino125oxadiazol3yl)5((4benzylpiperidin1yl)methyl)N(4methylbenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((4benzylpiperidin1yl)methyl)N((E)(4methylphenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((4benzylpiperidin1yl)methyl)N((E)(4methylphenyl)methylideneamino)triazole4carboxamide
861118867
CC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCC(CC4)CC5=CC=CC=C5
Cc1ccc(cc1)C=NNC(=O)c1nnn(c1CN1CCC(CC1)Cc1ccccc1)c1nonc1N
InChI=1SC26H29N9O2c1187921(10818)16283026(36)2322(35(332923)2524(27)31373225)1734131120(121434)15195324619h2101620H111517H21H3(H22731)(H3036)b2816+
MFCD05683182
ZINC000013803981
ZINC34829016

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Available files

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