Vitas-M small molecule compound
(3E)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-{[(2-methoxy-5-methylphenyl)amino](oxo)acetyl}hydrazinylidene)butanamide
Catalog ID
STK117153
SMILES COc1ccc(cc1NC(=O)C(=O)N/N=C(/CC(=O)Nc1ccc2c(c1)OCCO2)\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 C22H24N4O6 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O6/c1-13-4-6-17(30-3)16(10-13)24-21(28)22(29)26-25-14(2)11-20(27)23-15-5-7-18-19(12-15)32-9-8-31-18/h4-7,10,12H,8-9,11H2,1-3H3,(H,23,27)(H,24,28)(H,26,29)/b25-14+InChIKey
WHBSZMRRNUTCEZ-AFUMVMLFSA-NSynonyms
(3E)N(23DIHYDRO14BENZODIOXIN6YL)3(2(((2METHOXY5METHYLPHENYL)AMINO)(OXO)ACETYL)HYDRAZINYLIDENE)BUTANAMIDE
(E)N(23dihydrobenzo(b)(14)dioxin6yl)3(2(2((2methoxy5methylphenyl)amino)2oxoacetyl)hydrazono)butanamide
CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NN=C(C)CC(=O)NC2=CC3=C(C=C2)OCCO3
COc1ccc(cc1NC(=O)C(=O)NN=C(CC(=O)Nc1ccc2c(c1)OCCO2)C)C
InChI=1SC22H24N4O6c1134617(303)16(1013)2421(28)22(29)262514(2)1120(27)2315571819(1215)32983118h471012H8911H213H3(H2327)(H2428)(H2629)b2514+
MFCD00752450
N((E)(4(23dihydro14benzodioxin6ylamino)4oxobutan2ylidene)amino)N(2methoxy5methylphenyl)oxamide
ZINC000009805442
ZINC101540957
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