Vitas-M small molecule compound
4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenyl 2,4-dichlorobenzoate
Catalog ID
STK681817
SMILES COc1cc(ccc1OC(=O)c1ccc(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 C33H27Cl2NO4 MW 572.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27Cl2NO4/c1-33(2)16-23-29-21-7-5-4-6-18(21)8-12-25(29)36-31(30(23)26(37)17-33)19-9-13-27(28(14-19)39-3)40-32(38)22-11-10-20(34)15-24(22)35/h4-15,31,36H,16-17H2,1-3H3InChIKey
DKNXMFSDQDEOII-UHFFFAOYSA-NSynonyms
(4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)2methoxyphenyl)24dichlorobenzoate
4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)2methoxyphenyl24dichlorobenzoate
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)OC(=O)C6=C(C=C(C=C6)Cl)Cl)OC)C(=O)C1)C
InChI=1SC33H27Cl2NO4c133(2)16232921754618(21)81225(29)3631(30(23)26(37)1733)1991327(28(1419)393)4032(38)22111020(34)1524(22)35h4153136H1617H213H3
MFCD03820157
ZINC000098005259
ZINC000098005260
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