Triethylamine 3-[2-(4-oxo-3-phenyl-2-thioxo-5-thiazolidinylidene)-3-benzothiazolinyl]-1-propanesulfonate

SpectraBase Compound ID	GGTPddpz7Kj
InChI	InChI=1S/C19H16N2O4S4.C6H15N/c22-17-16(28-19(26)21(17)13-7-2-1-3-8-13)18-20(11-6-12-29(23,24)25)14-9-4-5-10-15(14)27-18;1-4-7(5-2)6-3/h1-5,7-10H,6,11-12H2,(H,23,24,25);4-6H2,1-3H3/b18-16+;
InChIKey	UOJIDSWVJGIMJI-HYNBPGMHSA-N Google Search
Mol Weight	565.8 g/mol
Molecular Formula	C25H31N3O4S4
Exact Mass	565.119741 g/mol

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SpectraBase Spectrum ID	bNU10mWGal
Name	Triethylamine 3-[2-(4-oxo-3-phenyl-2-thioxo-5-thiazolidinylidene)-3-benzothiazolinyl]-1-propanesulfonate
Alternate Name(s)	Triethylamine 3-[2-(4-oxo-3-phenyl-2-thioxo-5-thiazolidinylidene)-3- N,N-diethylethanamine;3-[(2E)-2-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]-1-propanesulfonic acid N,N-diethylethanamine;3-[(2E)-2-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propane-1-sulfonic acid N,N-diethylethanamine;3-[(2E)-2-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propane-1-sulfonic acid N,N-diethylethanamine;3-[(2E)-2-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propane-1-sulfonic acid
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Formula	C25H31N3O4S4
InChI	InChI=1S/C19H16N2O4S4.C6H15N/c22-17-16(28-19(26)21(17)13-7-2-1-3-8-13)18-20(11-6-12-29(23,24)25)14-9-4-5-10-15(14)27-18;1-4-7(5-2)6-3/h1-5,7-10H,6,11-12H2,(H,23,24,25);4-6H2,1-3H3/b18-16+;
InChIKey	UOJIDSWVJGIMJI-HYNBPGMHSA-N
Molecular Weight	565.780 g/mol
SMILES	C(N(CC)CC)C.OS(CCCN1\C(=C\2C(N(C(S2)=S)c2ccccc2)=O)Sc2c1cccc2)(=O)=O
SPLASH	splash10-0553-9300000000-d027507cc846c1f2742e
Source of Spectrum	CM-1999-3328-0
Wiley ID	465682