Vitas-M small molecule compound
5-{2-[(2,4-dichlorobenzyl)oxy]-3-methoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK674006
SMILES COc1cccc(c1OCc1ccc(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 C33H29Cl2NO3 MW 558.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29Cl2NO3/c1-33(2)16-24-29-22-8-5-4-7-19(22)12-14-26(29)36-31(30(24)27(37)17-33)23-9-6-10-28(38-3)32(23)39-18-20-11-13-21(34)15-25(20)35/h4-15,31,36H,16-18H2,1-3H3InChIKey
IKRUEPWKIWXHJR-UHFFFAOYSA-NSynonyms
5(2((24dichlorobenzyl)oxy)3methoxyphenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
5(2((24dichlorophenyl)methoxy)3methoxyphenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=C(C(=CC=C5)OC)OCC6=C(C=C(C=C6)Cl)Cl)C(=O)C1)C
InChI=1SC33H29Cl2NO3c133(2)16242922854719(22)121426(29)3631(30(24)27(37)1733)23961028(383)32(23)391820111321(34)1525(20)35h4153136H1618H213H3
MFCD01066292
ZINC000006077133
ZINC000006077208
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