2-[3-[[4-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)amino]phenyl]carbonylamino]phenyl]sulfonylethyl hydrogen sulfate

Systemtic Name: 2-[3-[[4-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)amino]phenyl]carbonylamino]phenyl]sulfonylethyl hydrogen sulfate Openeye Name: 2-[3-[[4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]benzoyl]amino]phenyl]sulfonylethyl hydrogen sulfate CAS Name: sulfuric acid 2-[3-[[[4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]phenyl]-oxomethyl]amino]phenyl]sulfonylethyl ester IUPAC Name: 2-[3-[[4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]benzoyl]amino]phenyl]sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[3-[[4-[(4-chloro-6-methyl-s-triazin-2-yl)amino]benzoyl]amino]phenyl]sulfonylethyl ester Formula: C19H18ClN5O7S2 MolecularWeight: 527.95852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)Cl)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)CCOS(=O)(=O)O

Isomeric SMILES

CC1=NC(=NC(=N1)Cl)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C19H18ClN5O7S2/c1-12-21-18(20)25-19(22-12)24-14-7-5-13(6-8-14)17(26)23-15-3-2-4-16(11-15)33(27,28)10-9-32-34(29,30)31/h2-8,11H,9-10H2,1H3,(H,23,26)(H,29,30,31)(H,21,22,24,25)