3-(quinazolin-4-ylamino)benzenesulfonate

Systemtic Name: 3-(quinazolin-4-ylamino)benzenesulfonate Openeye Name: 3-(quinazolin-4-ylamino)benzenesulfonate CAS Name: 3-(4-quinazolinylamino)benzenesulfonate IUPAC Name: 3-(quinazolin-4-ylamino)benzenesulfonate Traditional Name: 3-(quinazolin-4-ylamino)besylate Formula: C14H10N3O3S- MolecularWeight: 300.3125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C14H11N3O3S/c18-21(19,20)11-5-3-4-10(8-11)17-14-12-6-1-2-7-13(12)15-9-16-14/h1-9H,(H,15,16,17)(H,18,19,20)/p-1