Vitas-M small molecule compound

1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxyphenyl)thiourea

Catalog ID
STK144410
SMILES COc1ccccc1NC(=S)NCc1ccc2c(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 C16H16N2O3S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S/c1-19-13-5-3-2-4-12(13)18-16(22)17-9-11-6-7-14-15(8-11)21-10-20-14/h2-8H,9-10H2,1H3,(H2,17,18,22)
InChIKey
HJSKHLNCDVQKAX-UHFFFAOYSA-N
Synonyms
406925-57-3
((2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINO)((2METHOXYPHENYL)AMINO)METHANE1THIONE
1(13BENZODIOXOL5YLMETHYL)3(2METHOXYPHENYL)THIOUREA
1(benzo(d)(13)dioxol5ylmethyl)3(2methoxyphenyl)thiourea
406925573
COC1=CC=CC=C1NC(=S)NCC2=CC3=C(C=C2)OCO3
InChI=1SC16H16N2O3Sc11913532412(13)1816(22)17911671415(811)21102014h28H910H21H3(H2171822)
MFCD02711876
N(13BENZODIOXOL5YLMETHYL)N(2METHOXYPHENYL)THIOUREA
ZINC000008683661
ZINC08683661
ZINC8683661

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Available files

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