Vitas-M small molecule compound
11-(3-ethoxy-4-hydroxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK106755
SMILES CCOc1cc(ccc1O)C1Nc2ccccc2NC2=C1C(=O)CCC2
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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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-2-26-19-12-13(10-11-17(19)24)21-20-16(8-5-9-18(20)25)22-14-6-3-4-7-15(14)23-21/h3-4,6-7,10-12,21-24H,2,5,8-9H2,1H3InChIKey
DLKJDCMSUYIMHY-UHFFFAOYSA-NSynonyms
11(3ethoxy4hydroxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3ethoxy4hydroxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)NC4=CC=CC=C4N2)O
InChI=1SC21H22N2O3c1226191213(101117(19)24)212016(85918(20)25)2214634715(14)2321h346710122124H2589H21H3
MFCD02640647
ZINC000003904856
ZINC000003904857
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