Vitas-M small molecule compound
11-(3-chloro-5-ethoxy-4-hydroxyphenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403389
SMILES CCOc1cc(cc(c1O)Cl)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 C25H29ClN2O3 MW 440.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN2O3/c1-6-31-21-10-15(9-16(26)24(21)30)23-22-19(11-25(4,5)12-20(22)29)27-17-7-13(2)14(3)8-18(17)28-23/h7-10,23,27-28,30H,6,11-12H2,1-5H3InChIKey
ZHVJSRZXIJMSLS-UHFFFAOYSA-NSynonyms
11(3chloro5ethoxy4hydroxyphenyl)3378tetramethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3chloro5ethoxy4hydroxyphenyl)2399tetramethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C(N2)C=C(C(=C4)C)C)Cl)O
InChI=1SC25H29ClN2O3c1631211015(916(26)24(21)30)232219(1125(45)1220(22)29)2717713(2)14(3)818(17)2823h71023272830H61112H215H3
MFCD03408365
ZINC000000720755
ZINC000000720756
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