Vitas-M small molecule compound

methyl N'-(2-phenylethyl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)carbamimidothioate

Catalog ID
STL173315
SMILES CS/C(=N\CCc1ccccc1)/NCC12CC3CC(C2)CC(C1)C3

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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 C21H30N2S MW 342.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2S/c1-24-20(22-8-7-16-5-3-2-4-6-16)23-15-21-12-17-9-18(13-21)11-19(10-17)14-21/h2-6,17-19H,7-15H2,1H3,(H,22,23)
InChIKey
CAJLCULZYXZUMH-UHFFFAOYSA-N
Synonyms
866763-28-2
866763282
CSC(=NCC12CC3CC(C1)CC(C3)C2)NCCC4=CC=CC=C4
CSC(=NCCc1ccccc1)NCC12CC3CC(C2)CC(C1)C3
InChI=1SC21H30N2Sc12420(2287165324616)2315211217918(1321)1119(1017)1421h261719H715H21H3(H2223)
methylN(1adamantylmethyl)N(2phenylethyl)carbamimidothioate
methylN(2phenylethyl)N(tricyclo(3311~37~)dec1ylmethyl)carbamimidothioate
ZINC000020617936
ZINC20617936

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Available files

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