Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]thiourea
Catalog ID
STK460076
SMILES S=C(Nc1cnn(c1)Cc1ccc(cc1)C)Nc1ccc2c(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 C19H18N4O2S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S/c1-13-2-4-14(5-3-13)10-23-11-16(9-20-23)22-19(26)21-15-6-7-17-18(8-15)25-12-24-17/h2-9,11H,10,12H2,1H3,(H2,21,22,26)InChIKey
MEVWRDZODSCZEY-UHFFFAOYSA-NSynonyms
(2HBENZO(D)13DIOXOLAN5YLAMINO)((1((4METHYLPHENYL)METHYL)PYRAZOL4YL)AMINO)METHANE1THIONE
1(13benzodioxol5yl)3(1((4methylphenyl)methyl)pyrazol4yl)thiourea
1(13benzodioxol5yl)3(1(4methylbenzyl)1Hpyrazol4yl)thiourea
CC1=CC=C(C=C1)CN2C=C(C=N2)NC(=S)NC3=CC4=C(C=C3)OCO4
InChI=1SC19H18N4O2Sc1132414(5313)10231116(92023)2219(26)2115671718(815)25122417h2911H1012H21H3(H2212226)
MFCD04279262
ZINC000006966050
ZINC06966050
ZINC6966050
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