2-[2-[[3-(2-Carboxyethyl)-5-Chloro-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-5-Chloro-3-(3-Sulpho
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Product Description
Product
2-[2-[[3-(2-Carboxyethyl)-5-Chloro-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-5-Chloro-3-(3-Sulpho
CAS
94232-70-9
Formula
C25H24Cl2N2O5S3
Typical Product Specifications
Molecular weight
599.57
EINECS
303-998-9
SMILES
s1c([n+](c2c1ccc(c2)Cl)CCCS(=O)(=O)[O-])\C=C(\CC)\C=C1\Sc2c(N1CCC(=O)O)cc(cc2)Cl
InChI
UPMBCOCBOLASHO-UHFFFAOYSA-N
InChIKey
1S/C25H24Cl2N2O5S3/c1-2-16(13-24-29(10-8-25(30)31)20-15-18(27)5-7-22(20)36-24)12-23-28(9-3-11-37(32,33)34)19-14-17(26)4-6-21(19)35-23/h4-7,12-15H,2-3,8-11H2,1H3,(H-,30,31,32,33,34)
Class
2-[2-[[3-(2-Carboxyethyl)-5-Chloro-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-5-Chloro-3-(3-Sulpho
Product Description
Product
2-[2-[[3-(2-Carboxyethyl)-5-Chloro-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-5-Chloro-3-(3-Sulpho
CAS
94232-70-9
Formula
C25H24Cl2N2O5S3
Typical Product Specifications
Molecular weight
599.57
EINECS
303-998-9
SMILES
s1c([n+](c2c1ccc(c2)Cl)CCCS(=O)(=O)[O-])\C=C(\CC)\C=C1\Sc2c(N1CCC(=O)O)cc(cc2)Cl
InChI
UPMBCOCBOLASHO-UHFFFAOYSA-N
InChIKey
1S/C25H24Cl2N2O5S3/c1-2-16(13-24-29(10-8-25(30)31)20-15-18(27)5-7-22(20)36-24)12-23-28(9-3-11-37(32,33)34)19-14-17(26)4-6-21(19)35-23/h4-7,12-15H,2-3,8-11H2,1H3,(H-,30,31,32,33,34)
Class
