Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea
Catalog ID
STK456942
SMILES COc1cc(CCNC(=S)Nc2ccc3c(c2)OCO3)ccc1OC
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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 C18H20N2O4S MW 360.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S/c1-21-14-5-3-12(9-16(14)22-2)7-8-19-18(25)20-13-4-6-15-17(10-13)24-11-23-15/h3-6,9-10H,7-8,11H2,1-2H3,(H2,19,20,25)InChIKey
LNXHNSYBYSHRHZ-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLAMINO)((2(34DIMETHOXYPHENYL)ETHYL)AMINO)METHANE1THIONE
1(13benzodioxol5yl)3(2(34dimethoxyphenyl)ethyl)thiourea
COC1=C(C=C(C=C1)CCNC(=S)NC2=CC3=C(C=C2)OCO3)OC
InChI=1SC18H20N2O4Sc121145312(916(14)222)781918(25)2013461517(1013)24112315h36910H7811H212H3(H2192025)
MFCD03161393
ZINC000002858334
ZINC02858334
ZINC2858334
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