Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(E)-(5-bromo-2-butoxyphenyl)methylidene]propanehydrazide
Catalog ID
STK435934
SMILES CCCCOc1ccc(cc1/C=N/NC(=O)C(Sc1nc2c(s1)cccc2)C)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 C21H22BrN3O2S2 MW 492.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O2S2/c1-3-4-11-27-18-10-9-16(22)12-15(18)13-23-25-20(26)14(2)28-21-24-17-7-5-6-8-19(17)29-21/h5-10,12-14H,3-4,11H2,1-2H3,(H,25,26)/b23-13+InChIKey
MMRPNCPVIGKLIU-YDZHTSKRSA-NSynonyms
2(13benzothiazol2ylsulfanyl)N((E)(5bromo2butoxyphenyl)methylidene)propanehydrazide
2(13benzothiazol2ylsulfanyl)N((E)(5bromo2butoxyphenyl)methylideneamino)propanamide
CCCCOC1=C(C=C(C=C1)Br)C=NNC(=O)C(C)SC2=NC3=CC=CC=C3S2
CCCCOc1ccc(cc1C=NNC(=O)C(Sc1nc2c(s1)cccc2)C)Br
InChI=1SC21H22BrN3O2S2c13411271810916(22)1215(18)13232520(26)14(2)28212417756819(17)2921h5101214H3411H212H3(H2526)b2313+
MFCD03944309
N((1E)2(5BROMO2BUTOXYPHENYL)1AZAVINYL)2BENZOTHIAZOL2YLTHIOPROPANAMIDE
ZINC000020562673
ZINC000020562676
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