Vitas-M small molecule compound
7'-chloro-3'-(4-methoxyphenyl)-4,4-dimethyl-2',3',4',4a'-tetrahydro-1'H,2H,6H,6'H-spiro[cyclohexane-1,5'-pyrazino[1,2-a]quinoline]-2,6-dione
Catalog ID
STK617658
SMILES COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)CC(CC1=O)(C)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 C26H29ClN2O3 MW 452.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O3/c1-25(2)14-23(30)26(24(31)15-25)13-19-20(27)5-4-6-21(19)29-12-11-28(16-22(26)29)17-7-9-18(32-3)10-8-17/h4-10,22H,11-16H2,1-3H3InChIKey
CTXFSRUUUKGRHJ-UHFFFAOYSA-NSynonyms
929863-26-37chloro3(4methoxyphenyl)44dimethyl12344a6hexahydrospiro(cyclohexane15pyrazino(12a)quinoline)26dione
7chloro3(4methoxyphenyl)44dimethyl2344atetrahydro1H2H6H6Hspiro(cyclohexane15pyrazino(12a)quinoline)26dione
7chloro3(4methoxyphenyl)55dimethylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline52cyclohexane)13dione
929863263
CC1(CC(=O)C2(CC3=C(C=CC=C3Cl)N4C2CN(CC4)C5=CC=C(C=C5)OC)C(=O)C1)C
InChI=1SC26H29ClN2O3c125(2)1423(30)26(24(31)1525)131920(27)54621(19)29121128(1622(26)29)177918(323)10817h41022H1116H213H3
MFCD09798280
ZINC000009423847
ZINC000009423848
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