Vitas-M small molecule compound

1-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-3-phenylthiourea

Catalog ID
STK830726
SMILES S=C(Nc1ccccc1)NCC1COc2c(O1)cccc2

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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 C16H16N2O2S MW 300.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O2S/c21-16(18-12-6-2-1-3-7-12)17-10-13-11-19-14-8-4-5-9-15(14)20-13/h1-9,13H,10-11H2,(H2,17,18,21)
InChIKey
PNXZASNIXZQSIR-UHFFFAOYSA-N
Synonyms
356574-54-4
((2H3HBENZO(E)14DIOXIN2YLMETHYL)AMINO)(PHENYLAMINO)METHANE1THIONE
1((23dihydrobenzo(b)(14)dioxin2yl)methyl)3phenylthiourea
1(23dihydro14benzodioxin2ylmethyl)3phenylthiourea
1(23DIHYDRO14BENZODIOXIN3YLMETHYL)3PHENYLTHIOUREA
356574544
C1C(OC2=CC=CC=C2O1)CNC(=S)NC3=CC=CC=C3
InChI=1SC16H16N2O2Sc2116(18126213712)171013111914845915(14)2013h1913H1011H2(H2171821)
MFCD01100800
N(23DIHYDRO14BENZODIOXIN2YLMETHYL)NPHENYLTHIOUREA
ZINC000000447086
ZINC000004812466

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Available files

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