Vitas-M small molecule compound

N-cyclohexyl-2-phenyl-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide

Catalog ID
STK291080
SMILES O=C(C(c1ccccc1)Sc1nnnn1c1ccccc1)NC1CCCCC1

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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 C21H23N5OS MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5OS/c27-20(22-17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)28-21-23-24-25-26(21)18-14-8-3-9-15-18/h1,3-5,8-11,14-15,17,19H,2,6-7,12-13H2,(H,22,27)
InChIKey
LLZZXTVNLUOILC-UHFFFAOYSA-N
Synonyms
936821-11-3
936821113
C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)SC3=NN=NN3C4=CC=CC=C4
InChI=1SC21H23N5OSc2720(2217126271317)19(16104151116)282123242526(21)18148391518h13581114151719H2671213H2(H2227)
MFCD09455835
Ncyclohexyl2phenyl2((1phenyl1Htetrazol5yl)sulfanyl)acetamide
Ncyclohexyl2phenyl2(1phenyltetrazol5yl)sulfanylacetamide
ZINC000009027074
ZINC000009027077

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Available files

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