2-[4-[[2-(cyanoimino)hexahydro-4,6-dioxopyrimidin-5-yl]azo]phenyl]-6-methylbenzothiazole-7-sulphonic
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Product Description
Product
2-[4-[[2-(cyanoimino)hexahydro-4,6-dioxopyrimidin-5-yl]azo]phenyl]-6-methylbenzothiazole-7-sulphonic
CAS
55067-14-6
Formula
C19H13N7O5S2
Typical Product Specifications
Molecular weight
483.48
EINECS
259-469-7
SMILES
O=C1N=C(NC(=O)[C@@H]1\N=N\c1ccc(cc1)c1nc2c(c(S(=O)(=O)O)c(cc2)C)s1)NC#N
InChI
STSWYQLPKUGPRL-OCEACIFDSA-N
InChIKey
1S/C19H13N7O5S2/c1-9-2-7-12-14(15(9)33(29,30)31)32-18(22-12)10-3-5-11(6-4-10)25-26-13-16(27)23-19(21-8-20)24-17(13)28/h2-7,13H,1H3,(H,29,30,31)(H2,21,23,24,27,28)/b26-25+
Class
2-[4-[[2-(cyanoimino)hexahydro-4,6-dioxopyrimidin-5-yl]azo]phenyl]-6-methylbenzothiazole-7-sulphonic
Product Description
Product
2-[4-[[2-(cyanoimino)hexahydro-4,6-dioxopyrimidin-5-yl]azo]phenyl]-6-methylbenzothiazole-7-sulphonic
CAS
55067-14-6
Formula
C19H13N7O5S2
Typical Product Specifications
Molecular weight
483.48
EINECS
259-469-7
SMILES
O=C1N=C(NC(=O)[C@@H]1\N=N\c1ccc(cc1)c1nc2c(c(S(=O)(=O)O)c(cc2)C)s1)NC#N
InChI
STSWYQLPKUGPRL-OCEACIFDSA-N
InChIKey
1S/C19H13N7O5S2/c1-9-2-7-12-14(15(9)33(29,30)31)32-18(22-12)10-3-5-11(6-4-10)25-26-13-16(27)23-19(21-8-20)24-17(13)28/h2-7,13H,1H3,(H,29,30,31)(H2,21,23,24,27,28)/b26-25+
Class
