Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-1,1-dipentylthiourea
Catalog ID
STK496485
SMILES CCCCCN(C(=S)Nc1ccc2c(c1)OCO2)CCCCC
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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 C18H28N2O2S MW 336.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N2O2S/c1-3-5-7-11-20(12-8-6-4-2)18(23)19-15-9-10-16-17(13-15)22-14-21-16/h9-10,13H,3-8,11-12,14H2,1-2H3,(H,19,23)InChIKey
SSBWOIXJQXFUAT-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)11dipentylthiourea
CCCCCN(CCCCC)C(=S)NC1=CC2=C(C=C1)OCO2
InChI=1SC18H28N2O2Sc13571120(128642)18(23)19159101617(1315)22142116h91013H38111214H212H3(H1923)
MFCD06171873
ZINC000013824640
ZINC13824640
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