Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-11-(3-phenoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK047915
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccc(c1)Oc1ccccc1
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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 C33H30N2O4 MW 518.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2O4/c1-37-30-16-15-21(20-31(30)38-2)23-18-28-32(29(36)19-23)33(35-27-14-7-6-13-26(27)34-28)22-9-8-12-25(17-22)39-24-10-4-3-5-11-24/h3-17,20,23,33-35H,18-19H2,1-2H3InChIKey
IWMJWWNRHGYHOW-UHFFFAOYSA-NSynonyms
297157-92-7297157927
3(34dimethoxyphenyl)11(3phenoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(34dimethoxyphenyl)6(3phenoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=CC=C5)OC6=CC=CC=C6)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccc(c1)Oc1ccccc1
InChI=1SC33H30N2O4c13730161521(2031(30)382)23182832(29(36)1923)33(352714761326(27)3428)22981225(1722)3924104351124h31720233335H1819H212H3
MFCD01988841
STK047915
ZINC000004081672
ZINC000004081689
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