Vitas-M small molecule compound
2-ethoxy-4-(1-oxo-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclohexanecarboxylate
Catalog ID
STK020549
SMILES CCOc1cc(ccc1OC(=O)C1CCCCC1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
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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 C34H36N2O4 MW 536.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N2O4/c1-2-39-31-21-24(17-18-30(31)40-34(38)23-13-7-4-8-14-23)33-32-28(35-26-15-9-10-16-27(26)36-33)19-25(20-29(32)37)22-11-5-3-6-12-22/h3,5-6,9-12,15-18,21,23,25,33,35-36H,2,4,7-8,13-14,19-20H2,1H3InChIKey
LUSZUGHWOXRANK-UHFFFAOYSA-NSynonyms
(2ethoxy4(7oxo9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin6yl)phenyl)cyclohexanecarboxylate
2ETHOXY4(1OXO3PHENYL(234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN11YL))PHENYLCYCLOHEXANECARBOXYLATE
2ethoxy4(1oxo3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)phenylcyclohexanecarboxylate
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=CC=CC=C5N2)OC(=O)C6CCCCC6
CCOc1cc(ccc1OC(=O)C1CCCCC1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
InChI=1SC34H36N2O4c1239312124(171830(31)4034(38)23137481423)333228(3526159101627(26)3633)1925(2029(32)37)22115361222h3569121518212325333536H247813141920H21H3
MFCD02068213
STK020549
ZINC000004082019
ZINC000004082027
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