Vitas-M small molecule compound

2-(cyclohexylmethyl)-5-(2-phenylethyl)-1,3,4-thiadiazole

Catalog ID
STK166339
SMILES C1CCC(CC1)Cc1nnc(s1)CCc1ccccc1

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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 C17H22N2S MW 286.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2S/c1-3-7-14(8-4-1)11-12-16-18-19-17(20-16)13-15-9-5-2-6-10-15/h1,3-4,7-8,15H,2,5-6,9-13H2
InChIKey
VXWDEPGVXUSZQK-UHFFFAOYSA-N
Synonyms

2(CYCLOHEXYLMETHYL)5(2PHENYLETHYL)134THIADIAZOLE
2(CYCLOHEXYLMETHYL)5PHENETHYL134THIADIAZOLE
C1CCC(CC1)CC2=NN=C(S2)CCC3=CC=CC=C3
InChI=1SC17H22N2Sc13714(841)111216181917(2016)131595261015h1347815H256913H2
MFCD08678562
ZINC000004702599
ZINC04702599
ZINC4702599

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.