Vitas-M small molecule compound
3-chloro-2-(3,4-dimethoxyphenyl)-5-(2-methylphenyl)-1-benzoxepine
Catalog ID
STK806088
SMILES COc1ccc(cc1OC)C1=C(Cl)C=C(c2c(O1)cccc2)c1ccccc1C
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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 C25H21ClO3 MW 404.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClO3/c1-16-8-4-5-9-18(16)20-15-21(26)25(29-22-11-7-6-10-19(20)22)17-12-13-23(27-2)24(14-17)28-3/h4-15H,1-3H3InChIKey
FBZZSGYVYWLWPN-UHFFFAOYSA-NSynonyms
3chloro2(34dimethoxyphenyl)5(2methylphenyl)1benzoxepine
3chloro2(34dimethoxyphenyl)5(otolyl)benzo(b)oxepine
CC1=CC=CC=C1C2=CC(=C(OC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC)Cl
InChI=1SC25H21ClO3c116845918(16)201521(26)25(292211761019(20)22)17121323(272)24(1417)283h415H13H3
MFCD01179380
ZINC000002298779
ZINC02298779
ZINC2298779
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