2-nitrobenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine

Systemtic Name: 2-nitrobenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine Openeye Name: 2-nitrobenzenesulfonic acid; 4-phenylthiazol-2-amine CAS Name: 2-nitrobenzenesulfonic acid; 4-phenyl-2-thiazolamine IUPAC Name: 2-nitrobenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine Traditional Name: 2-nitrobesylic acid; (4-phenylthiazol-2-yl)amine Formula: C15H13N3O5S2 MolecularWeight: 379.41082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)N.C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)N.C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C9H8N2S.C6H5NO5S/c10-9-11-8(6-12-9)7-4-2-1-3-5-7;8-7(9)5-3-1-2-4-6(5)13(10,11)12/h1-6H,(H2,10,11);1-4H,(H,10,11,12)