Vitas-M small molecule compound

1-benzyl-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-ethoxyphenyl)thiourea

Catalog ID
STK516706
SMILES CCOc1ccc(cc1)NC(=S)N(C1CCS(=O)(=O)C1)Cc1ccccc1

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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 C20H24N2O3S2 MW 404.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O3S2/c1-2-25-19-10-8-17(9-11-19)21-20(26)22(14-16-6-4-3-5-7-16)18-12-13-27(23,24)15-18/h3-11,18H,2,12-15H2,1H3,(H,21,26)
InChIKey
DOXNNZQEUHEHPD-UHFFFAOYSA-N
Synonyms
874011-69-5
1benzyl1(11dioxidotetrahydrothiophen3yl)3(4ethoxyphenyl)thiourea
1benzyl1(11dioxothiolan3yl)3(4ethoxyphenyl)thiourea
874011695
CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)C3CCS(=O)(=O)C3
InChI=1SC20H24N2O3S2c12251910817(91119)2120(26)22(14166435716)18121327(2324)1518h31118H21215H21H3(H2126)
MFCD06645783
ZINC000007735980
ZINC000007735981

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Available files

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