Vitas-M small molecule compound

1-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-3-phenylthiourea

Catalog ID
STK020673
SMILES S=C(NC(C1COc2c(O1)cccc2)C)Nc1ccccc1

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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 C17H18N2O2S MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2S/c1-12(18-17(22)19-13-7-3-2-4-8-13)16-11-20-14-9-5-6-10-15(14)21-16/h2-10,12,16H,11H2,1H3,(H2,18,19,22)
InChIKey
OFWGWRCVTONDAC-UHFFFAOYSA-N
Synonyms

1(1(23DIHYDRO14BENZODIOXIN2YL)ETHYL)3PHENYLTHIOUREA
1(1(23DIHYDRO14BENZODIOXIN3YL)ETHYL)3PHENYLTHIOUREA
1(1(23DIHYDROBENZO(14)DIOXIN2YL)ETHYL)3PHENYLTHIOUREA
1(1(23dihydrobenzo(b)(14)dioxin2yl)ethyl)3phenylthiourea
CC(C1COC2=CC=CC=C2O1)NC(=S)NC3=CC=CC=C3
InChI=1SC17H18N2O2Sc112(1817(22)19137324813)161120149561015(14)2116h2101216H11H21H3(H2181922)
MFCD01897638
S=C(NC(C1COc2c(O1)cccc2)C)Nc1ccccc1
STK020673
ZINC000008691054
ZINC000008691938

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Available files

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