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1-cyanoethylimino-[[4-(1H-imidazol-5-yl)phenyl]amino]methanesulfonic acid
1-cyanoethylimino-[[4-(1H-imidazol-5-yl)phenyl]amino]methanesulfonic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC(C#N)N=C(NC1=CC=C(C=C1)C2=CN=CN2)S(=O)(=O)O
Isomeric SMILES
CC(C#N)N=C(NC1=CC=C(C=C1)C2=CN=CN2)S(=O)(=O)O
InChI
InChI=1S/C13H13N5O3S/c1-9(6-14)17-13(22(19,20)21)18-11-4-2-10(3-5-11)12-7-15-8-16-12/h2-5,7-9H,1H3,(H,15,16)(H,17,18)(H,19,20,21)
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