6-azanyl-3-(4-oxidanyl-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6-azanyl-3-(4-oxidanyl-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-(4-hydroxy-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-(4-hydroxy-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-(4-hydroxy-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(4-hydroxy-1,3-benzothiazol-2-yl)-4aH-quinazolin-3-ium-4-one Formula: C15H11N4O2S+ MolecularWeight: 311.33844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=N2)[N+]3=CN=C4C=CC(=CC4C3=O)N)O

Isomeric SMILES

C1=CC(=C2C(=C1)SC(=N2)[N+]3=CN=C4C=CC(=CC4C3=O)N)O

InChI

InChI=1S/C15H10N4O2S/c16-8-4-5-10-9(6-8)14(21)19(7-17-10)15-18-13-11(20)2-1-3-12(13)22-15/h1-7,9H,16H2/p+1