Vitas-M small molecule compound

1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(propan-2-yl)phenyl]thiourea

Catalog ID
STK682938
SMILES S=C(Nc1ccc(cc1)C(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)14-4-6-15(7-5-14)20-18(23)19-10-13-3-8-16-17(9-13)22-11-21-16/h3-9,12H,10-11H2,1-2H3,(H2,19,20,23)
InChIKey
DIHAIQMNURSQGG-UHFFFAOYSA-N
Synonyms
485370-60-3
1(13benzodioxol5ylmethyl)3(4(propan2yl)phenyl)thiourea
1(13BENZODIOXOL5YLMETHYL)3(4PROPAN2YLPHENYL)THIOUREA
485370603
CC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3
InChI=1SC18H20N2O2Sc112(2)144615(7514)2018(23)191013381617(913)22112116h3912H1011H212H3(H2192023)
MFCD03959510
THIOUREA1BENZO(13)DIOXOL5YLMETHYL3(4ISOPROPYLPHENYL)
ZINC000013684448
ZINC13684448

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Available files

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