Vitas-M small molecule compound

4,4-dimethyl-2-{[2-(morpholin-4-yl)ethyl]amino}-6-oxo-N-(4-phenoxyphenyl)cyclohex-1-ene-1-carbothioamide

Catalog ID
STK115918
SMILES O=C1CC(C)(C)CC(=C1C(=S)Nc1ccc(cc1)Oc1ccccc1)NCCN1CCOCC1

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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 C27H33N3O3S MW 479.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O3S/c1-27(2)18-23(28-12-13-30-14-16-32-17-15-30)25(24(31)19-27)26(34)29-20-8-10-22(11-9-20)33-21-6-4-3-5-7-21/h3-11,28H,12-19H2,1-2H3,(H,29,34)
InChIKey
WQZSVCFCDBFKFB-UHFFFAOYSA-N
Synonyms

44DIMETHYL2((2(MORPHOLIN4YL)ETHYL)AMINO)6OXON(4PHENOXYPHENYL)CYCLOHEX1ENE1CARBOTHIOAMIDE
44DIMETHYL2(2MORPHOLIN4YLETHYLAMINO)6OXON(4PHENOXYPHENYL)CYCLOHEXENE1CARBOTHIOAMIDE
CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)NCCN4CCOCC4)C
InChI=1SC27H33N3O3Sc127(2)1823(28121330141632171530)25(24(31)1927)26(34)292081022(11920)33216435721h31128H1219H212H3(H2934)
MFCD03778902
ZINC000100156803
ZINC100156803

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Available files

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