Vitas-M small molecule compound
2-ethoxy-4-(3,3,7,8-tetramethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclopropanecarboxylate
Catalog ID
STK380279
SMILES CCOc1cc(ccc1OC(=O)C1CC1)C1Nc2cc(C)c(cc2NC2=C1C(=O)CC(C2)(C)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 C29H34N2O4 MW 474.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O4/c1-6-34-25-13-19(9-10-24(25)35-28(33)18-7-8-18)27-26-22(14-29(4,5)15-23(26)32)30-20-11-16(2)17(3)12-21(20)31-27/h9-13,18,27,30-31H,6-8,14-15H2,1-5H3InChIKey
YZDRUFGBFNSKOU-UHFFFAOYSA-NSynonyms
(2ethoxy4(2399tetramethyl7oxo681011tetrahydro5Hbenzo(b)(14)benzodiazepin6yl)phenyl)cyclopropanecarboxylate
2ethoxy4(3378tetramethyl1oxo23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)phenylcyclopropanecarboxylate
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C(N2)C=C(C(=C4)C)C)OC(=O)C5CC5
InChI=1SC29H34N2O4c1634251319(91024(25)3528(33)187818)272622(1429(45)1523(26)32)30201116(2)17(3)1221(20)3127h91318273031H681415H215H3
MFCD02104292
ZINC000001481057
ZINC000001481058
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