Vitas-M small molecule compound
N-(4-ethoxyphenyl)-2-{(2E)-2-[(17E)-3-methoxyestra-1(10),2,4-trien-17-ylidene]hydrazinyl}-2-oxoacetamide
Catalog ID
STL181754
SMILES CCOc1ccc(cc1)NC(=O)C(=O)N/N=C/1\CCC2C1(C)CCC1C2CCc2c1ccc(c2)OC
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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 C29H35N3O4 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35N3O4/c1-4-36-20-8-6-19(7-9-20)30-27(33)28(34)32-31-26-14-13-25-24-11-5-18-17-21(35-3)10-12-22(18)23(24)15-16-29(25,26)2/h6-10,12,17,23-25H,4-5,11,13-16H2,1-3H3,(H,30,33)(H,32,34)/b31-26+InChIKey
MNXVBXWQINRGGF-GKPLWNPISA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)C(=O)NN=C2CCC3C2(CCC4C3CCC5=C4C=CC(=C5)OC)C
CCOc1ccc(cc1)NC(=O)C(=O)NN=C1CCC2C1(C)CCC1C2CCc2c1ccc(c2)OC
InChI=1SC29H35N3O4c1436208619(7920)3027(33)28(34)32312614132524115181721(353)101222(18)23(24)151629(2526)2h61012172325H45111316H213H3(H3033)(H3234)b3126+
MFCD20760127
N(4ethoxyphenyl)2((2E)2((17E)3methoxyestra1(10)24trien17ylidene)hydrazinyl)2oxoacetamide
N(4ethoxyphenyl)N((E)(3methoxy13methyl7891112141516octahydro6Hcyclopenta(a)phenanthren17ylidene)amino)oxamide
ZINC000226441336
ZINC000245253748
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