Vitas-M small molecule compound

1-(1,3-benzodioxol-5-yl)-3-[2-(methylsulfanyl)phenyl]thiourea

Catalog ID
STK457000
SMILES CSc1ccccc1NC(=S)Nc1ccc2c(c1)OCO2

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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 C15H14N2O2S2 MW 318.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O2S2/c1-21-14-5-3-2-4-11(14)17-15(20)16-10-6-7-12-13(8-10)19-9-18-12/h2-8H,9H2,1H3,(H2,16,17,20)
InChIKey
MYVQWCKPXKFQIF-UHFFFAOYSA-N
Synonyms

(2HBENZO(34D)13DIOXOLAN5YLAMINO)((2METHYLTHIOPHENYL)AMINO)METHANE1THIONE
1(13benzodioxol5yl)3(2(methylsulfanyl)phenyl)thiourea
1(13BENZODIOXOL5YL)3(2METHYLSULFANYLPHENYL)THIOUREA
CSC1=CC=CC=C1NC(=S)NC2=CC3=C(C=C2)OCO3
InChI=1SC15H14N2O2S2c12114532411(14)1715(20)1610671213(810)1991812h28H9H21H3(H2161720)
MFCD04220644
ZINC000000611971
ZINC00611971
ZINC611971

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Available files

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