Vitas-M small molecule compound
[4-(1,2-benzothiazol-3-yl)piperazin-1-yl](4-bromophenyl)methanethione
Catalog ID
STK621373
SMILES Brc1ccc(cc1)C(=S)N1CCN(CC1)c1nsc2c1cccc2
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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 C18H16BrN3S2 MW 418.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3S2/c19-14-7-5-13(6-8-14)18(23)22-11-9-21(10-12-22)17-15-3-1-2-4-16(15)24-20-17/h1-8H,9-12H2InChIKey
ANFYVOUAHRDYRN-UHFFFAOYSA-NSynonyms
951998-77-9(4(12benzothiazol3yl)piperazin1yl)(4bromophenyl)methanethione
(4(benzo(d)isothiazol3yl)piperazin1yl)(4bromophenyl)methanethione
951998779
C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)C4=CC=C(C=C4)Br
InChI=1SC18H16BrN3S2c19147513(6814)18(23)2211921(101222)1715312416(15)242017h18H912H2
MFCD09854317
ZINC000013693703
ZINC13693703
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