Vitas-M small molecule compound
3-chloro-2-(3,4-dimethoxyphenyl)-5-(4-methylphenyl)-1-benzoxepine
Catalog ID
STK792740
SMILES COc1ccc(cc1OC)C1=C(Cl)C=C(c2c(O1)cccc2)c1ccc(cc1)C
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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/c1-16-8-10-17(11-9-16)20-15-21(26)25(29-22-7-5-4-6-19(20)22)18-12-13-23(27-2)24(14-18)28-3/h4-15H,1-3H3InChIKey
IVBWRYGQQLYQRI-UHFFFAOYSA-NSynonyms
380643-57-2380643572
3chloro2(34dimethoxyphenyl)5(4methylphenyl)1benzoxepine
3chloro2(34dimethoxyphenyl)5(ptolyl)benzo(b)oxepine
CC1=CC=C(C=C1)C2=CC(=C(OC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC)Cl
InChI=1SC25H21ClO3c11681017(11916)201521(26)25(2922754619(20)22)18121323(272)24(1418)283h415H13H3
MFCD02942780
ZINC000001782829
ZINC01782829
ZINC1782829
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