2-[2-[[5-bromo-3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]but-1-enyl]-3-ethyl-5,6-dimet
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Product Description
Product
2-[2-[[5-bromo-3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]but-1-enyl]-3-ethyl-5,6-dimet
CAS
39981-04-9
Formula
C26H29BrN2O3S3
Typical Product Specifications
Molecular weight
593.62
EINECS
254-732-2
SMILES
CC/C(=C/c1[n+](c2cc(c(cc2s1)C)C)CC)/C=C\3/N(c4cc(ccc4S3)Br)CCCS(=O)(=O)[O-]
InChI
SIWBZPYXOLAGLL-UHFFFAOYSA-N
InChIKey
1S/C26H29BrN2O3S3/c1-5-19(14-25-28(6-2)21-12-17(3)18(4)13-24(21)34-25)15-26-29(10-7-11-35(30,31)32)22-16-20(27)8-9-23(22)33-26/h8-9,12-16H,5-7,10-11H2,1-4H3
Class
2-[2-[[5-bromo-3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]but-1-enyl]-3-ethyl-5,6-dimet
Product Description
Product
2-[2-[[5-bromo-3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]but-1-enyl]-3-ethyl-5,6-dimet
CAS
39981-04-9
Formula
C26H29BrN2O3S3
Typical Product Specifications
Molecular weight
593.62
EINECS
254-732-2
SMILES
CC/C(=C/c1[n+](c2cc(c(cc2s1)C)C)CC)/C=C\3/N(c4cc(ccc4S3)Br)CCCS(=O)(=O)[O-]
InChI
SIWBZPYXOLAGLL-UHFFFAOYSA-N
InChIKey
1S/C26H29BrN2O3S3/c1-5-19(14-25-28(6-2)21-12-17(3)18(4)13-24(21)34-25)15-26-29(10-7-11-35(30,31)32)22-16-20(27)8-9-23(22)33-26/h8-9,12-16H,5-7,10-11H2,1-4H3
Class
