3-[(2-chloranylquinazolin-4-yl)amino]benzenesulfonic acid

Systemtic Name: 3-[(2-chloranylquinazolin-4-yl)amino]benzenesulfonic acid Openeye Name: 3-[(2-chloroquinazolin-4-yl)amino]benzenesulfonic acid CAS Name: 3-[(2-chloro-4-quinazolinyl)amino]benzenesulfonic acid IUPAC Name: 3-[(2-chloroquinazolin-4-yl)amino]benzenesulfonic acid Traditional Name: 3-[(2-chloroquinazolin-4-yl)amino]besylic acid Formula: C14H10ClN3O3S MolecularWeight: 335.7655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C14H10ClN3O3S/c15-14-17-12-7-2-1-6-11(12)13(18-14)16-9-4-3-5-10(8-9)22(19,20)21/h1-8H,(H,16,17,18)(H,19,20,21)