Vitas-M small molecule compound
2-{[(4-bromobenzyl)sulfanyl]acetyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)hydrazinecarbothioamide
Catalog ID
STK446851
SMILES O=C(NNC(=S)Nc1ccc2c(c1)OCCO2)CSCc1ccc(cc1)Br
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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 C18H18BrN3O3S2 MW 468.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O3S2/c19-13-3-1-12(2-4-13)10-27-11-17(23)21-22-18(26)20-14-5-6-15-16(9-14)25-8-7-24-15/h1-6,9H,7-8,10-11H2,(H,21,23)(H2,20,22,26)InChIKey
KOHRSFUEOLGEEX-UHFFFAOYSA-NSynonyms
1((2((4bromophenyl)methylsulfanyl)acetyl)amino)3(23dihydro14benzodioxin6yl)thiourea
2(((4bromobenzyl)sulfanyl)acetyl)N(23dihydro14benzodioxin6yl)hydrazinecarbothioamide
C1COC2=C(O1)C=CC(=C2)NC(=S)NNC(=O)CSCC3=CC=C(C=C3)Br
InChI=1SC18H18BrN3O3S2c19133112(2413)10271117(23)212218(26)2014561516(914)25872415h169H781011H2(H2123)(H2202226)
MFCD04058856
N(((2H3HBENZO(34E)14DIOXIN6YLAMINO)THIOXOMETHYL)AMINO)2((4BROMOPHENYL)METHYLTHIO)ACETAMIDE
ZINC000020457945
ZINC20457945
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