Vitas-M small molecule compound
1-[1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
Catalog ID
STK447017
SMILES S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)Nc1ccc2c(c1)OCCO2
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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 C19H17ClN4O2S MW 400.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O2S/c20-14-3-1-13(2-4-14)12-24-8-7-18(23-24)22-19(27)21-15-5-6-16-17(11-15)26-10-9-25-16/h1-8,11H,9-10,12H2,(H2,21,22,23,27)InChIKey
TURXTMSTJWDIKD-UHFFFAOYSA-NSynonyms
(2H3HBENZO(34E)14DIOXIN6YLAMINO)((1((4CHLOROPHENYL)METHYL)PYRAZOL3YL)AMINO)METHANE1THIONE
1(1((4chlorophenyl)methyl)pyrazol3yl)3(23dihydro14benzodioxin6yl)thiourea
1(1(4chlorobenzyl)1Hpyrazol3yl)3(23dihydro14benzodioxin6yl)thiourea
C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=NN(C=C3)CC4=CC=C(C=C4)Cl
InChI=1SC19H17ClN4O2Sc20143113(2414)12248718(2324)2219(27)2115561617(1115)261092516h1811H91012H2(H221222327)
MFCD04058873
ZINC000006402463
ZINC06402463
ZINC6402463
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