Vitas-M small molecule compound

3-[(4-benzylpiperidin-1-yl)methyl]-5-(4-tert-butylphenyl)-1,3,4-oxadiazole-2(3H)-thione

Catalog ID
STK034263
SMILES CC(c1ccc(cc1)c1oc(=S)n(n1)CN1CCC(CC1)Cc1ccccc1)(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 C25H31N3OS MW 421.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3OS/c1-25(2,3)22-11-9-21(10-12-22)23-26-28(24(30)29-23)18-27-15-13-20(14-16-27)17-19-7-5-4-6-8-19/h4-12,20H,13-18H2,1-3H3
InChIKey
PROWRXNJFRKDKR-UHFFFAOYSA-N
Synonyms

3((4benzylpiperidin1yl)methyl)5(4(tertbutyl)phenyl)134oxadiazole2(3H)thione
3((4BENZYLPIPERIDIN1YL)METHYL)5(4TERTBUTYLPHENYL)134OXADIAZOLE2(3H)THIONE
3((4BENZYLPIPERIDIN1YL)METHYL)5(4TERTBUTYLPHENYL)134OXADIAZOLE2THIONE
CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCC(CC3)CC4=CC=CC=C4
CC(c1ccc(cc1)c1oc(=S)n(n1)CN1CCC(CC1)Cc1ccccc1)(C)C
InChI=1SC25H31N3OSc125(23)2211921(101222)232628(24(30)2923)1827151320(141627)17197546819h41220H1318H213H3
MFCD01125034
STK034263
ZINC000002290437
ZINC2290437

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Available files

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