Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(2E)-1-phenoxypropan-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL153542
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/COc1ccccc1)\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 C22H29N9O3 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N9O3/c1-15(14-33-17-11-7-4-8-12-17)24-26-22(32)19-18(13-30(2)16-9-5-3-6-10-16)31(29-25-19)21-20(23)27-34-28-21/h4,7-8,11-12,16H,3,5-6,9-10,13-14H2,1-2H3,(H2,23,27)(H,26,32)/b24-15+InChIKey
GIJQLIYKNUDIKF-BUVRLJJBSA-NSynonyms
862104-81-2(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(1phenoxypropan2ylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((2E)1phenoxypropan2ylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((CYCLOHEXYL(METHYL)AMINO)METHYL)N((E)1PHENOXYPROPAN2YLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
862104812
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CN(C)C3CCCCC3)COC4=CC=CC=C4
CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)NN=C(COc1ccccc1)C
InChI=1SC22H29N9O3c115(143317117481217)242622(32)1918(1330(2)1695361016)31(292519)2120(23)27342821h478111216H3569101314H212H3(H22327)(H2632)b2415+
MFCD05686691
ZINC000009497722
ZINC34780193
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