Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperidin-1-ylmethyl)-N'-[(2E,3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK674560
SMILES C/C(=N\NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)/C=C/C1=C(C)CCCC1(C)C
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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 C24H35N9O2 MW 481.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35N9O2/c1-16-9-8-12-24(3,4)18(16)11-10-17(2)26-28-23(34)20-19(15-32-13-6-5-7-14-32)33(31-27-20)22-21(25)29-35-30-22/h10-11H,5-9,12-15H2,1-4H3,(H2,25,29)(H,28,34)/b11-10+,26-17+InChIKey
XBVDHAKNNJGXQV-JUWNEVKWSA-NSynonyms
1(4amino125oxadiazol3yl)5(piperidin1ylmethyl)N((2E3E)4(266trimethylcyclohex1en1yl)but3en2ylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(PIPERIDIN1YLMETHYL)N((E)((E)4(266TRIMETHYLCYCLOHEXEN1YL)BUT3EN2YLIDENE)AMINO)TRIAZOLE4CARBOXAMIDE
CC(=NNC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)C=CC1=C(C)CCCC1(C)C
CC1=C(C(CCC1)(C)C)C=CC(=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCCCC4)C
InChI=1SC24H35N9O2c116981224(34)18(16)111017(2)262823(34)2019(1532136571432)33(312720)2221(25)29353022h1011H591215H214H3(H22529)(H2834)b1110+2617+
MFCD01459930
ZINC000004482093
ZINC33296096
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