3-(quinazolin-4-ylamino)benzenesulfonic acid

Systemtic Name: 3-(quinazolin-4-ylamino)benzenesulfonic acid Openeye Name: 3-(quinazolin-4-ylamino)benzenesulfonic acid CAS Name: 3-(4-quinazolinylamino)benzenesulfonic acid IUPAC Name: 3-(quinazolin-4-ylamino)benzenesulfonic acid Traditional Name: 3-(quinazolin-4-ylamino)besylic acid Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

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)