Vitas-M small molecule compound
2-[(E)-{2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]-4-bromophenyl 4-methylbenzenesulfonate
Catalog ID
STK361887
SMILES O=C(CSc1nc2c(s1)cccc2)N/N=C/c1cc(Br)ccc1OS(=O)(=O)c1ccc(cc1)C
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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 C23H18BrN3O4S3 MW 576.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O4S3/c1-15-6-9-18(10-7-15)34(29,30)31-20-11-8-17(24)12-16(20)13-25-27-22(28)14-32-23-26-19-4-2-3-5-21(19)33-23/h2-13H,14H2,1H3,(H,27,28)/b25-13+InChIKey
BTWMLDFERWJZKX-DHRITJCHSA-NSynonyms
(2((E)((2(13benzothiazol2ylsulfanyl)acetyl)hydrazinylidene)methyl)4bromophenyl)4methylbenzenesulfonate
2((1E)2(2BENZOTHIAZOL2YLTHIOACETYLAMINO)2AZAVINYL)4BROMOPHENYL4METHYLBENZENESULFONATE
2((E)(2((13BENZOTHIAZOL2YLSULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)4BROMOPHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)CSC3=NC4=CC=CC=C4S3
InChI=1SC23H18BrN3O4S3c1156918(10715)34(2930)312011817(24)1216(20)13252722(28)1432232619423521(19)3323h213H14H21H3(H2728)b2513+
MFCD01874142
O=C(CSc1nc2c(s1)cccc2)NN=Cc1cc(Br)ccc1OS(=O)(=O)c1ccc(cc1)C
ZINC000097962792
ZINC100140288
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