Vitas-M small molecule compound

4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenyl 4-fluorobenzenesulfonate

Catalog ID
STK675160
SMILES COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)F)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 C32H28FNO5S MW 557.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28FNO5S/c1-32(2)17-24-29-23-7-5-4-6-19(23)8-14-25(29)34-31(30(24)26(35)18-32)20-9-15-27(28(16-20)38-3)39-40(36,37)22-12-10-21(33)11-13-22/h4-16,31,34H,17-18H2,1-3H3
InChIKey
SCFQGIKXYIEBHB-UHFFFAOYSA-N
Synonyms

(4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)2methoxyphenyl)4fluorobenzenesulfonate
4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)2methoxyphenyl4fluorobenzenesulfonate
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)OS(=O)(=O)C6=CC=C(C=C6)F)OC)C(=O)C1)C
InChI=1SC32H28FNO5Sc132(2)17242923754619(23)81425(29)3431(30(24)26(35)1832)2091527(28(1620)383)3940(3637)22121021(33)111322h4163134H1718H213H3
MFCD01160975
ZINC000003668599
ZINC000003668600

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Available files

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