Vitas-M small molecule compound
5-{4-[(2,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK755949
SMILES CCOc1cc(ccc1OCc1ccc(cc1Cl)Cl)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
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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 C34H31Cl2NO3 MW 572.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31Cl2NO3/c1-4-39-30-15-21(11-14-29(30)40-19-22-9-12-23(35)16-26(22)36)33-32-25(17-34(2,3)18-28(32)38)31-24-8-6-5-7-20(24)10-13-27(31)37-33/h5-16,33,37H,4,17-19H2,1-3H3InChIKey
QFRCKFQRUFBEEO-UHFFFAOYSA-NSynonyms
5(4((24dichlorobenzyl)oxy)3ethoxyphenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
5(4((24dichlorophenyl)methoxy)3ethoxyphenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)OCC6=C(C=C(C=C6)Cl)Cl
InChI=1SC34H31Cl2NO3c1439301521(111429(30)40192291223(35)1626(22)36)333225(1734(23)1828(32)38)3124865720(24)101327(31)3733h5163337H41719H213H3
MFCD01066032
ZINC000002188119
ZINC000002188120
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