2-[2-[(5-chloro-3-ethyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]-5,6-dimethyl-3-(3-sulphonatopro
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Product Description
Product
2-[2-[(5-chloro-3-ethyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]-5,6-dimethyl-3-(3-sulphonatopro
CAS
29213-78-3
Formula
C26H29ClN2O3S3
Typical Product Specifications
Molecular weight
549.17
EINECS
249-515-4
SMILES
CC/C(=C/c1[n+](c2cc(c(cc2s1)C)C)CCCS(=O)(=O)[O-])/C=C\3/N(c4cc(ccc4S3)Cl)CC
InChI
YJQBFLHCXFMMNZ-UHFFFAOYSA-N
InChIKey
1S/C26H29ClN2O3S3/c1-5-19(14-25-28(6-2)22-16-20(27)8-9-23(22)33-25)15-26-29(10-7-11-35(30,31)32)21-12-17(3)18(4)13-24(21)34-26/h8-9,12-16H,5-7,10-11H2,1-4H3
Class
2-[2-[(5-chloro-3-ethyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]-5,6-dimethyl-3-(3-sulphonatopro
Product Description
Product
2-[2-[(5-chloro-3-ethyl-3H-benzothiazol-2-ylidene)methyl]but-1-enyl]-5,6-dimethyl-3-(3-sulphonatopro
CAS
29213-78-3
Formula
C26H29ClN2O3S3
Typical Product Specifications
Molecular weight
549.17
EINECS
249-515-4
SMILES
CC/C(=C/c1[n+](c2cc(c(cc2s1)C)C)CCCS(=O)(=O)[O-])/C=C\3/N(c4cc(ccc4S3)Cl)CC
InChI
YJQBFLHCXFMMNZ-UHFFFAOYSA-N
InChIKey
1S/C26H29ClN2O3S3/c1-5-19(14-25-28(6-2)22-16-20(27)8-9-23(22)33-25)15-26-29(10-7-11-35(30,31)32)21-12-17(3)18(4)13-24(21)34-26/h8-9,12-16H,5-7,10-11H2,1-4H3
Class
