Vitas-M small molecule compound
(1Z)-5-(4-chloro-2-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)pentan-2-one
Catalog ID
STK585661
SMILES COc1cc2/C(=C/C(=O)CCCOc3ccc(cc3C)Cl)/NCCc2cc1OC
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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 C23H26ClNO4 MW 415.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClNO4/c1-15-11-17(24)6-7-21(15)29-10-4-5-18(26)13-20-19-14-23(28-3)22(27-2)12-16(19)8-9-25-20/h6-7,11-14,25H,4-5,8-10H2,1-3H3/b20-13-InChIKey
GZJDCASTSALHTR-MOSHPQCFSA-NSynonyms
883951-29-9(1Z)5(4chloro2methylphenoxy)1(67dimethoxy34dihydro2Hisoquinolin1ylidene)pentan2one
(1Z)5(4chloro2methylphenoxy)1(67dimethoxy34dihydroisoquinolin1(2H)ylidene)pentan2one
(Z)5(4chloro2methylphenoxy)1(67dimethoxy34dihydroisoquinolin1(2H)ylidene)pentan2one
883951299
CC1=C(C=CC(=C1)Cl)OCCCC(=O)C=C2C3=CC(=C(C=C3CCN2)OC)OC
COc1cc2C(=CC(=O)CCCOc3ccc(cc3C)Cl)NCCc2cc1OC
InChI=1SC23H26ClNO4c1151117(24)6721(15)29104518(26)1320191423(283)22(272)1216(19)892520h67111425H45810H213H3b2013
MFCD07638664
ZINC000005389428
ZINC05389428
ZINC5389428
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