Vitas-M small molecule compound

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

Catalog ID
STK150070
SMILES S=C(Nc1ccccc1C(C)C)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 C18H20N2O2S MW 328.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O2S/c1-12(2)14-5-3-4-6-15(14)20-18(23)19-10-13-7-8-16-17(9-13)22-11-21-16/h3-9,12H,10-11H2,1-2H3,(H2,19,20,23)
InChIKey
NXQVOQLDRGBMQZ-UHFFFAOYSA-N
Synonyms

((2HBENZO(34D)13DIOXOLAN5YLMETHYL)AMINO)((2(METHYLETHYL)PHENYL)AMINO)METHANE1THIONE
1(13BENZODIOXOL5YLMETHYL)3(2(PROPAN2YL)PHENYL)THIOUREA
1(13BENZODIOXOL5YLMETHYL)3(2PROPAN2YLPHENYL)THIOUREA
CC(C)C1=CC=CC=C1NC(=S)NCC2=CC3=C(C=C2)OCO3
InChI=1SC18H20N2O2Sc112(2)14534615(14)2018(23)191013781617(913)22112116h3912H1011H212H3(H2192023)
MFCD04221550
ZINC000002226227
ZINC02226227
ZINC2226227

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Available files

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