Vitas-M small molecule compound
3-chloro-5-(4-methoxyphenyl)-4-methylidene-2-(4-methylphenyl)-4,5-dihydro-1-benzoxepine
Catalog ID
STK792754
SMILES COc1ccc(cc1)C1C(=C)C(=C(Oc2c1cccc2)c1ccc(cc1)C)Cl
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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 C25H21ClO2 MW 388.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClO2/c1-16-8-10-19(11-9-16)25-24(26)17(2)23(18-12-14-20(27-3)15-13-18)21-6-4-5-7-22(21)28-25/h4-15,23H,2H2,1,3H3InChIKey
YRGGHHJUEBPGNT-UHFFFAOYSA-NSynonyms
696595-96-7(5R)3CHLORO5(4METHOXYPHENYL)4METHYLIDENE2(4METHYLPHENYL)45DIHYDRO1BENZOXEPINE
(5S)3CHLORO5(4METHOXYPHENYL)4METHYLIDENE2(4METHYLPHENYL)45DIHYDRO1BENZOXEPINE
3chloro5(4methoxyphenyl)4methylene2(ptolyl)45dihydrobenzo(b)oxepine
3chloro5(4methoxyphenyl)4methylidene2(4methylphenyl)45dihydro1benzoxepine
3CHLORO5(4METHOXYPHENYL)4METHYLIDENE2(4METHYLPHENYL)5H1BENZOXEPINE
696595967
CC1=CC=C(C=C1)C2=C(C(=C)C(C3=CC=CC=C3O2)C4=CC=C(C=C4)OC)Cl
InChI=1SC25H21ClO2c11681019(11916)2524(26)17(2)23(18121420(273)151318)21645722(21)2825h41523H2H213H3
MFCD04146812
ZINC000002107643
ZINC000002107645
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