2-[[5,5-dimethyl-3-[[3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]cyclohex-2-en-1-ylidene
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Product Description
Product
2-[[5,5-dimethyl-3-[[3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]cyclohex-2-en-1-ylidene
CAS
64285-48-9
Formula
C29H32N2O3S3
Typical Product Specifications
Molecular weight
552.77
EINECS
264-768-0
SMILES
s1c([n+](c2c1cccc2)CC)\C=C1\C=C(CC(C1)(C)C)\C=C1/Sc2c(N1CCCS(=O)(=O)[O-])cccc2
InChI
YRFUOEGOPWKHQT-UHFFFAOYSA-N
InChIKey
1S/C29H32N2O3S3/c1-4-30-23-10-5-7-12-25(23)35-27(30)17-21-16-22(20-29(2,3)19-21)18-28-31(14-9-15-37(32,33)34)24-11-6-8-13-26(24)36-28/h5-8,10-13,16-18H,4,9,14-15,19-20H2,1-3H3
Class
2-[[5,5-dimethyl-3-[[3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]cyclohex-2-en-1-ylidene
Product Description
Product
2-[[5,5-dimethyl-3-[[3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]cyclohex-2-en-1-ylidene
CAS
64285-48-9
Formula
C29H32N2O3S3
Typical Product Specifications
Molecular weight
552.77
EINECS
264-768-0
SMILES
s1c([n+](c2c1cccc2)CC)\C=C1\C=C(CC(C1)(C)C)\C=C1/Sc2c(N1CCCS(=O)(=O)[O-])cccc2
InChI
YRFUOEGOPWKHQT-UHFFFAOYSA-N
InChIKey
1S/C29H32N2O3S3/c1-4-30-23-10-5-7-12-25(23)35-27(30)17-21-16-22(20-29(2,3)19-21)18-28-31(14-9-15-37(32,33)34)24-11-6-8-13-26(24)36-28/h5-8,10-13,16-18H,4,9,14-15,19-20H2,1-3H3
Class
