Vitas-M small molecule compound
4'-{3-ethoxy-5-[(2-ethoxyethyl)sulfanyl]-4H-1,2,4-triazol-4-yl}-N-phenyl-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxamide
Catalog ID
STK524521
SMILES CCOCCSc1nnc(n1C1=C(C(=O)Nc2ccccc2)C2(Cc3c1cccc3)CCCCC2)OCC
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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 C30H36N4O3S MW 532.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N4O3S/c1-3-36-19-20-38-29-33-32-28(37-4-2)34(29)26-24-16-10-9-13-22(24)21-30(17-11-6-12-18-30)25(26)27(35)31-23-14-7-5-8-15-23/h5,7-10,13-16H,3-4,6,11-12,17-21H2,1-2H3,(H,31,35)InChIKey
LHJUMNPIMOQBHA-UHFFFAOYSA-NSynonyms
374549-96-91(3ETHOXY5(2ETHOXYETHYLSULFANYL)124TRIAZOL4YL)NPHENYLSPIRO(4HNAPHTHALENE31CYCLOHEXANE)2CARBOXAMIDE
374549969
4(3ethoxy5((2ethoxyethyl)sulfanyl)4H124triazol4yl)Nphenyl1Hspiro(cyclohexane12naphthalene)3carboxamide
4(3ethoxy5((2ethoxyethyl)thio)4H124triazol4yl)Nphenyl1Hspiro(cyclohexane12naphthalene)3carboxamide
CCOCCSC1=NN=C(N1C2=C(C3(CCCCC3)CC4=CC=CC=C42)C(=O)NC5=CC=CC=C5)OCC
InChI=1SC30H36N4O3Sc133619203829333228(3742)34(29)2624161091322(24)2130(17116121830)25(26)27(35)3123147581523h57101316H34611121721H212H3(H3135)
MFCD01957316
ZINC000013775261
ZINC13775261
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