Vitas-M small molecule compound
1-{3-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
Catalog ID
STK335191
SMILES S=C(Nc1ccc2c(c1)OCCO2)Nc1cccc(c1)Cn1ncc(c1)Cl
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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/c20-14-10-21-24(12-14)11-13-2-1-3-15(8-13)22-19(27)23-16-4-5-17-18(9-16)26-7-6-25-17/h1-5,8-10,12H,6-7,11H2,(H2,22,23,27)InChIKey
ITIYRIDHBRBKRL-UHFFFAOYSA-NSynonyms
(2H3HBENZO(34E)14DIOXIN6YLAMINO)((3((4CHLOROPYRAZOLYL)METHYL)PHENYL)AMINO)METHANE1THIONE
1(3((4chloro1Hpyrazol1yl)methyl)phenyl)3(23dihydro14benzodioxin6yl)thiourea
1(3((4chloropyrazol1yl)methyl)phenyl)3(23dihydro14benzodioxin6yl)thiourea
C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=CC=CC(=C3)CN4C=C(C=N4)Cl
InChI=1SC19H17ClN4O2Sc2014102124(1214)111321315(813)2219(27)2316451718(916)26762517h1581012H6711H2(H2222327)
MFCD04058817
ZINC000006402345
ZINC06402345
ZINC6402345
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