Vitas-M small molecule compound

1-(2-ethoxyphenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)thiourea

Catalog ID
STK472519
SMILES CCOc1ccccc1NC(=S)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 C20H28N2OS MW 344.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2OS/c1-2-23-18-6-4-3-5-17(18)22-19(24)21-13-20-10-14-7-15(11-20)9-16(8-14)12-20/h3-6,14-16H,2,7-13H2,1H3,(H2,21,22,24)
InChIKey
GZCFLYAYMWDUTD-UHFFFAOYSA-N
Synonyms

((ADAMANTANYLMETHYL)AMINO)((2ETHOXYPHENYL)AMINO)METHANE1THIONE
1(1adamantylmethyl)3(2ethoxyphenyl)thiourea
1(2ethoxyphenyl)3(tricyclo(3311~37~)dec1ylmethyl)thiourea
CCOC1=CC=CC=C1NC(=S)NCC23CC4CC(C2)CC(C4)C3
InChI=1SC20H28N2OSc122318643517(18)2219(24)2113201014715(1120)916(814)1220h361416H2713H21H3(H2212224)
ZINC000016276273
ZINC16276273

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Available files

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