Vitas-M small molecule compound
4-{(2Z)-2-[3-chloro-5-(4-fluorophenyl)-2-(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine
Catalog ID
STK548076
SMILES Cc1ccc(cc1)C1=C(Cl)/C(=C\CN2CCOCC2)/C(c2c(O1)cccc2)c1ccc(cc1)F
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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 C29H27ClFNO2 MW 475.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClFNO2/c1-20-6-8-22(9-7-20)29-28(30)25(14-15-32-16-18-33-19-17-32)27(21-10-12-23(31)13-11-21)24-4-2-3-5-26(24)34-29/h2-14,27H,15-19H2,1H3/b25-14-InChIKey
KUABJNYBUYPDTM-QFEZKATASA-NSynonyms
(Z)4(2(3chloro5(4fluorophenyl)2(ptolyl)benzo(b)oxepin4(5H)ylidene)ethyl)morpholinehydrochloride
4((2Z)2(3chloro5(4fluorophenyl)2(4methylphenyl)1benzoxepin4(5H)ylidene)ethyl)morpholine
4((2Z)2(3CHLORO5(4FLUOROPHENYL)2(4METHYLPHENYL)5H1BENZOXEPIN4YLIDENE)ETHYL)MORPHOLINE
CC1=CC=C(C=C1)C2=C(C(=CCN3CCOCC3)C(C4=CC=CC=C4O2)C5=CC=C(C=C5)F)Cl
Cc1ccc(cc1)C1=C(Cl)C(=CCN2CCOCC2)C(c2c(O1)cccc2)c1ccc(cc1)F
Cc1ccc(cc1)C1=C(Cl)C(=CCN2CCOCC2)C(c2c(O1)cccc2)c1ccc(cc1)FCl
InChI=1SC29H27ClFNO2c1206822(9720)2928(30)25(141532161833191732)27(21101223(31)131121)24423526(24)3429h21427H1519H21H3b2514
MFCD03301735
ZINC000020102768
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